2-[[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methyl]guanidine

Systemtic Name: 2-[[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methyl]guanidine Openeye Name: 2-[[4-isopropyl-5-phenylsulfanyl-1-(4-pyridylmethyl)imidazol-2-yl]methyl]guanidine CAS Name: 2-[[5-(phenylthio)-4-propan-2-yl-1-(pyridin-4-ylmethyl)-2-imidazolyl]methyl]guanidine IUPAC Name: 2-[[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methyl]guanidine Traditional Name: 2-[[4-isopropyl-5-(phenylthio)-1-(4-pyridylmethyl)imidazol-2-yl]methyl]guanidine Formula: C20H24N6S MolecularWeight: 380.50976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CN=C(N)N)CC2=CC=NC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CN=C(N)N)CC2=CC=NC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C20H24N6S/c1-14(2)18-19(27-16-6-4-3-5-7-16)26(13-15-8-10-23-11-9-15)17(25-18)12-24-20(21)22/h3-11,14H,12-13H2,1-2H3,(H4,21,22,24)