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

Systemtic Name: (9S)-4-chloranyl-9-[(S)-(6-methoxy-1H-benzimidazol-2-yl)sulfinyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Openeye Name: (9S)-4-chloro-9-[(S)-(6-methoxy-1H-benzimidazol-2-yl)sulfinyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine CAS Name: (9S)-4-chloro-9-[(S)-(6-methoxy-1H-benzimidazol-2-yl)sulfinyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine IUPAC Name: (9S)-4-chloro-9-[(S)-(6-methoxy-1H-benzimidazol-2-yl)sulfinyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Traditional Name: (9S)-4-chloro-9-[(S)-(6-methoxy-1H-benzimidazol-2-yl)sulfinyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)S(=O)C3CCCCC4=C(C=CN=C34)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)[S@@](=O)[C@H]3CCCCC4=C(C=CN=C34)Cl

InChI

InChI=1S/C18H18ClN3O2S/c1-24-11-6-7-14-15(10-11)22-18(21-14)25(23)16-5-3-2-4-12-13(19)8-9-20-17(12)16/h6-10,16H,2-5H2,1H3,(H,21,22)/t16-,25-/m0/s1