2-azanyl-5-[bis(azanyl)methylideneamino]-N-(4-phenethyl-1,3-thiazol-2-yl)-N-(phenylmethyl)pentanamide

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]-N-(4-phenethyl-1,3-thiazol-2-yl)-N-(phenylmethyl)pentanamide Openeye Name: 2-amino-N-benzyl-5-guanidino-N-(4-phenethylthiazol-2-yl)pentanamide CAS Name: 2-amino-5-(diaminomethylideneamino)-N-(4-phenethyl-2-thiazolyl)-N-(phenylmethyl)pentanamide IUPAC Name: 2-amino-N-benzyl-5-(diaminomethylideneamino)-N-(4-phenethyl-1,3-thiazol-2-yl)pentanamide Traditional Name: 2-amino-N-benzyl-5-guanidino-N-(4-phenethylthiazol-2-yl)valeramide Formula: C24H30N6OS MolecularWeight: 450.5996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CSC(=N2)N(CC3=CC=CC=C3)C(=O)C(CCCN=C(N)N)N

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CSC(=N2)N(CC3=CC=CC=C3)C(=O)C(CCCN=C(N)N)N

InChI

InChI=1S/C24H30N6OS/c25-21(12-7-15-28-23(26)27)22(31)30(16-19-10-5-2-6-11-19)24-29-20(17-32-24)14-13-18-8-3-1-4-9-18/h1-6,8-11,17,21H,7,12-16,25H2,(H4,26,27,28)