2-[6-[bis(azanyl)methylideneamino]hexyl]guanidine; N-(3-phenylsulfanylpropyl)methanamide

Systemtic Name: 2-[6-[bis(azanyl)methylideneamino]hexyl]guanidine; N-(3-phenylsulfanylpropyl)methanamide Openeye Name: 2-(6-guanidinohexyl)guanidine; N-(3-phenylsulfanylpropyl)formamide CAS Name: 2-[6-(diaminomethylideneamino)hexyl]guanidine; N-[3-(phenylthio)propyl]formamide IUPAC Name: 2-[6-(diaminomethylideneamino)hexyl]guanidine; N-(3-phenylsulfanylpropyl)formamide Traditional Name: 2-(6-guanidinohexyl)guanidine; N-[3-(phenylthio)propyl]formamide Formula: C18H33N7OS MolecularWeight: 395.56592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC=O.C(CCCN=C(N)N)CCN=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC=O.C(CCCN=C(N)N)CCN=C(N)N

InChI

InChI=1S/C10H13NOS.C8H20N6/c12-9-11-7-4-8-13-10-5-2-1-3-6-10;9-7(10)13-5-3-1-2-4-6-14-8(11)12/h1-3,5-6,9H,4,7-8H2,(H,11,12);1-6H2,(H4,9,10,13)(H4,11,12,14)