4-methoxy-9-(1-methylsulfonylbenzimidazol-2-yl)sulfinyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine

Systemtic Name: 4-methoxy-9-(1-methylsulfonylbenzimidazol-2-yl)sulfinyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Openeye Name: 4-methoxy-9-(1-methylsulfonylbenzimidazol-2-yl)sulfinyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine CAS Name: 4-methoxy-9-[(1-methylsulfonyl-2-benzimidazolyl)sulfinyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine IUPAC Name: 4-methoxy-9-(1-methylsulfonylbenzimidazol-2-yl)sulfinyl-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Traditional Name: 9-(1-mesylbenzimidazol-2-yl)sulfinyl-4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CCCCC(C2=NC=C1)S(=O)C3=NC4=CC=CC=C4N3S(=O)(=O)C

Isomeric SMILES

COC1=C2CCCCC(C2=NC=C1)S(=O)C3=NC4=CC=CC=C4N3S(=O)(=O)C

InChI

InChI=1S/C19H21N3O4S2/c1-26-16-11-12-20-18-13(16)7-3-6-10-17(18)27(23)19-21-14-8-4-5-9-15(14)22(19)28(2,24)25/h4-5,8-9,11-12,17H,3,6-7,10H2,1-2H3