9-(1H-benzimidazol-2-ylsulfanyl)-4-methoxy-3-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine

Systemtic Name: 9-(1H-benzimidazol-2-ylsulfanyl)-4-methoxy-3-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Openeye Name: 9-(1H-benzimidazol-2-ylsulfanyl)-4-methoxy-3-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine CAS Name: 9-(1H-benzimidazol-2-ylthio)-4-methoxy-3-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine IUPAC Name: 9-(1H-benzimidazol-2-ylsulfanyl)-4-methoxy-3-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Traditional Name: 9-(1H-benzimidazol-2-ylthio)-4-methoxy-3-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Formula: C19H21N3OS MolecularWeight: 339.45454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(CCCCC2=C1OC)SC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CN=C2C(CCCCC2=C1OC)SC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H21N3OS/c1-12-11-20-17-13(18(12)23-2)7-3-6-10-16(17)24-19-21-14-8-4-5-9-15(14)22-19/h4-5,8-9,11,16H,3,6-7,10H2,1-2H3,(H,21,22)