1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2-(2-oxidanyl-2-phenyl-ethyl)guanidine

Systemtic Name: 1-cyano-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2-(2-oxidanyl-2-phenyl-ethyl)guanidine Openeye Name: 1-cyano-2-(2-hydroxy-2-phenyl-ethyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine CAS Name: 1-cyano-2-(2-hydroxy-2-phenylethyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine IUPAC Name: 1-cyano-2-(2-hydroxy-2-phenylethyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine Traditional Name: 1-cyano-2-(2-hydroxy-2-phenyl-ethyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine Formula: C17H22N6OS MolecularWeight: 358.46118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCN(C#N)C(=NCC(C2=CC=CC=C2)O)N

Isomeric SMILES

CC1=C(N=CN1)CSCCN(C#N)C(=NCC(C2=CC=CC=C2)O)N

InChI

InChI=1S/C17H22N6OS/c1-13-15(22-12-21-13)10-25-8-7-23(11-18)17(19)20-9-16(24)14-5-3-2-4-6-14/h2-6,12,16,24H,7-10H2,1H3,(H2,19,20)(H,21,22)