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

Systemtic Name: 9-(1H-benzimidazol-2-ylsulfanyl)-4-(cyclopropylmethoxy)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Openeye Name: 9-(1H-benzimidazol-2-ylsulfanyl)-4-(cyclopropylmethoxy)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine CAS Name: 9-(1H-benzimidazol-2-ylthio)-4-(cyclopropylmethoxy)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine IUPAC Name: 9-(1H-benzimidazol-2-ylsulfanyl)-4-(cyclopropylmethoxy)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Traditional Name: 9-(1H-benzimidazol-2-ylthio)-4-(cyclopropylmethoxy)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C=CN=C2C(C1)SC3=NC4=CC=CC=C4N3)OCC5CC5

Isomeric SMILES

C1CCC2=C(C=CN=C2C(C1)SC3=NC4=CC=CC=C4N3)OCC5CC5

InChI

InChI=1S/C21H23N3OS/c1-4-8-19(26-21-23-16-6-2-3-7-17(16)24-21)20-15(5-1)18(11-12-22-20)25-13-14-9-10-14/h2-3,6-7,11-12,14,19H,1,4-5,8-10,13H2,(H,23,24)