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

Systemtic Name: (9R)-9-(1H-benzimidazol-2-ylsulfanyl)-4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Openeye Name: (9R)-9-(1H-benzimidazol-2-ylsulfanyl)-4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine CAS Name: (9R)-9-(1H-benzimidazol-2-ylthio)-4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine IUPAC Name: (9R)-9-(1H-benzimidazol-2-ylsulfanyl)-4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Traditional Name: (9R)-9-(1H-benzimidazol-2-ylthio)-4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CCCCC(C2=NC=C1)SC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=C2CCCC[C@H](C2=NC=C1)SC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H19N3OS/c1-22-15-10-11-19-17-12(15)6-2-5-9-16(17)23-18-20-13-7-3-4-8-14(13)21-18/h3-4,7-8,10-11,16H,2,5-6,9H2,1H3,(H,20,21)/t16-/m1/s1