1,1',5,5'-tetrakis(benzenesulfonyl)-3,3'-spirobi[2,4-dihydro-1,5-benzodiazepine]

Details

Stereochemistry	ACHIRAL
Molecular Formula	C41H36N4O8S4
Molecular Weight	841.007
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,1',5,5'-tetrakis(benzenesulfonyl)-3,3'-spirobi[2,4-dihydro-1,5-benzodiazepine]

Structure Search

SMILES

O=S(=O)(N1CC4(CN(C2=CC=CC=C12)S(=O)(=O)C3=CC=CC=C3)CN(C5=CC=CC=C5N(C4)S(=O)(=O)C6=CC=CC=C6)S(=O)(=O)C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChIKey=FXKPUKOPBVPOBM-UHFFFAOYSA-N

InChI=1S/C41H36N4O8S4/c46-54(47,33-17-5-1-6-18-33)42-29-41(30-43(38-26-14-13-25-37(38)42)55(48,49)34-19-7-2-8-20-34)31-44(56(50,51)35-21-9-3-10-22-35)39-27-15-16-28-40(39)45(32-41)57(52,53)36-23-11-4-12-24-36/h1-28H,29-32H2

HIDE SMILES / InChI

Molecular Formula	C41H36N4O8S4
Molecular Weight	841.007
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:57:23 GMT 2023` Edited by `admin` on `Sat Dec 16 12:57:23 GMT 2023`
Record UNII	568EYK99FC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,1',5,5'-tetrakis(benzenesulfonyl)-3,3'-spirobi[2,4-dihydro-1,5-benzodiazepine]

Common Name

English

1,1′,2,2′,4,4′,5,5′-Octahydro-1,1′,5,5′-tetrakis(phenylsulfonyl)-3,3′-spirobi[3H-1,5-benzodiazepine]

Common Name

English

NSC-305938

Code

English

3,3'-SPIROBI(3H-1,5-BENZODIAZEPINE), 1,1',2,2',4,4',5,5'-OCTAHYDRO-1,1',5,5'-TETRAKIS(PHENYLSULFONYL)-

Common Name

English

Code System Code Type Description

NSC

305938