2-[3-(1H-imidazol-5-yl)propyl]-1-[1-(phenylmethylsulfanyl)propan-2-yl]guanidine

Systemtic Name: 2-[3-(1H-imidazol-5-yl)propyl]-1-[1-(phenylmethylsulfanyl)propan-2-yl]guanidine Openeye Name: 1-(2-benzylsulfanyl-1-methyl-ethyl)-2-[3-(1H-imidazol-5-yl)propyl]guanidine CAS Name: 2-[3-(1H-imidazol-5-yl)propyl]-1-[1-(phenylmethylthio)propan-2-yl]guanidine IUPAC Name: 1-(1-benzylsulfanylpropan-2-yl)-2-[3-(1H-imidazol-5-yl)propyl]guanidine Traditional Name: 1-[2-(benzylthio)-1-methyl-ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine Formula: C17H25N5S MolecularWeight: 331.4789

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC1=CC=CC=C1)NC(=NCCCC2=CN=CN2)N

Isomeric SMILES

CC(CSCC1=CC=CC=C1)NC(=NCCCC2=CN=CN2)N

InChI

InChI=1S/C17H25N5S/c1-14(11-23-12-15-6-3-2-4-7-15)22-17(18)20-9-5-8-16-10-19-13-21-16/h2-4,6-7,10,13-14H,5,8-9,11-12H2,1H3,(H,19,21)(H3,18,20,22)