1-cyano-2-[3-(1H-imidazol-5-yl)propyl]-3-(2-phenylsulfanylethyl)guanidine

Systemtic Name: 1-cyano-2-[3-(1H-imidazol-5-yl)propyl]-3-(2-phenylsulfanylethyl)guanidine Openeye Name: 1-cyano-2-[3-(1H-imidazol-5-yl)propyl]-3-(2-phenylsulfanylethyl)guanidine CAS Name: 1-cyano-2-[3-(1H-imidazol-5-yl)propyl]-3-[2-(phenylthio)ethyl]guanidine IUPAC Name: 1-cyano-2-[3-(1H-imidazol-5-yl)propyl]-3-(2-phenylsulfanylethyl)guanidine Traditional Name: 1-cyano-2-[3-(1H-imidazol-5-yl)propyl]-3-[2-(phenylthio)ethyl]guanidine Formula: C16H20N6S MolecularWeight: 328.4352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=NCCCC2=CN=CN2)NC#N

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=NCCCC2=CN=CN2)NC#N

InChI

InChI=1S/C16H20N6S/c17-12-21-16(19-8-4-5-14-11-18-13-22-14)20-9-10-23-15-6-2-1-3-7-15/h1-3,6-7,11,13H,4-5,8-10H2,(H,18,22)(H2,19,20,21)