1-butyl-8-[(6-methyl-1H-benzimidazol-2-yl)sulfinylmethyl]-3,4-dihydro-2H-quinoline

Systemtic Name: 1-butyl-8-[(6-methyl-1H-benzimidazol-2-yl)sulfinylmethyl]-3,4-dihydro-2H-quinoline Openeye Name: 1-butyl-8-[(6-methyl-1H-benzimidazol-2-yl)sulfinylmethyl]-3,4-dihydro-2H-quinoline CAS Name: 1-butyl-8-[(6-methyl-1H-benzimidazol-2-yl)sulfinylmethyl]-3,4-dihydro-2H-quinoline IUPAC Name: 1-butyl-8-[(6-methyl-1H-benzimidazol-2-yl)sulfinylmethyl]-3,4-dihydro-2H-quinoline Traditional Name: 1-butyl-8-[(6-methyl-1H-benzimidazol-2-yl)sulfinylmethyl]-3,4-dihydro-2H-quinoline Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCC2=C1C(=CC=C2)CS(=O)C3=NC4=C(N3)C=C(C=C4)C

Isomeric SMILES

CCCCN1CCCC2=C1C(=CC=C2)CS(=O)C3=NC4=C(N3)C=C(C=C4)C

InChI

InChI=1S/C22H27N3OS/c1-3-4-12-25-13-6-9-17-7-5-8-18(21(17)25)15-27(26)22-23-19-11-10-16(2)14-20(19)24-22/h5,7-8,10-11,14H,3-4,6,9,12-13,15H2,1-2H3,(H,23,24)