2-[5-[bis(azanyl)methylideneamino]pentanoyl]-5-(phenylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[5-[bis(azanyl)methylideneamino]pentanoyl]-5-(phenylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 5-benzyl-2-(5-guanidinopentanoyl)thiazole-4-carboxamide CAS Name: 2-[5-(diaminomethylideneamino)-1-oxopentyl]-5-(phenylmethyl)-4-thiazolecarboxamide IUPAC Name: 5-benzyl-2-[5-(diaminomethylideneamino)pentanoyl]-1,3-thiazole-4-carboxamide Traditional Name: 5-benzyl-2-(5-guanidinopentanoyl)thiazole-4-carboxamide Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N=C(S2)C(=O)CCCCN=C(N)N)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N=C(S2)C(=O)CCCCN=C(N)N)C(=O)N

InChI

InChI=1S/C17H21N5O2S/c18-15(24)14-13(10-11-6-2-1-3-7-11)25-16(22-14)12(23)8-4-5-9-21-17(19)20/h1-3,6-7H,4-5,8-10H2,(H2,18,24)(H4,19,20,21)