N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-6-(2-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-6-(2-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-6-[(2-methyl-1-piperidyl)sulfonyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-6-[(2-methyl-1-piperidinyl)sulfonyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-6-(2-methylpiperidin-1-yl)sulfonyl-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-keto-6-(2-methylpiperidino)sulfonyl-1H-quinoline-4-carboxamide Formula: C28H34N4O4S MolecularWeight: 522.65896

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCCCN4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCCCN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H34N4O4S/c1-20-7-4-5-15-32(20)37(35,36)23-10-11-26-24(17-23)25(18-27(33)30-26)28(34)29-13-6-14-31-16-12-21-8-2-3-9-22(21)19-31/h2-3,8-11,17-18,20H,4-7,12-16,19H2,1H3,(H,29,34)(H,30,33)