N-[3-(imidazol-1-ylmethyl)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-[3-(1-imidazolylmethyl)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=CC=CC(=C3)CN4C=CN=C4

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=CC=CC(=C3)CN4C=CN=C4

InChI

InChI=1S/C21H22N4O3S/c1-29(27,28)25-10-3-5-17-13-18(7-8-20(17)25)21(26)23-19-6-2-4-16(12-19)14-24-11-9-22-15-24/h2,4,6-9,11-13,15H,3,5,10,14H2,1H3,(H,23,26)