TAN-1057C

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C13H25N9O3
Molecular Weight	355.3961
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1[C@H](CNC(=N)NC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)CC1=O

InChI

InChIKey=WXDPPHZLBSPZOA-JGVFFNPUSA-N

InChI=1S/C13H25N9O3/c1-22-8(6-19-12(16)21-13(17)25)10(24)20-7(5-9(22)23)3-2-4-18-11(14)15/h7-8H,2-6H2,1H3,(H,20,24)(H4,14,15,18)(H5,16,17,19,21,25)/t7-,8+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C13H25N9O3
Molecular Weight	355.3961
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 10:26:03 GMT 2025` Edited by `admin` on `Wed Apr 02 10:26:03 GMT 2025`
Record UNII	7TWX2V5P6Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TAN-1057C

Common Name

English

(E)-[2-[[(2R,5S)-5-[3-(diaminomethylideneamino)propyl]-1-methyl-3,7-dioxo-1,4-diazepan-2-yl]methyl]hydrazinyl]methylideneurea

Preferred Name

English

UREA, (((((2R,5S)-5-(3-((AMINOIMINOMETHYL)AMINO)PROPYL)HEXAHYDRO-1-METHYL-3,7-DIOXO-1H-1,4-DIAZEPIN-2-YL)METHYL)AMINO)IMINOMETHYL)-

Systematic Name

English

UREA, ((((5-(3-((AMINOIMINOMETHYL)AMINO)PROPYL)HEXAHYDRO-1-METHYL-3,7-DIOXO-1H-1,4-DIAZEPIN-2-YL)METHYL)AMINO)IMINOMETHYL)-, (2R-TRANS)-

Systematic Name

English

Code System Code Type Description

WIKIPEDIA

TAN-1057 C