N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide

Systemtic Name: N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: N-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide CAS Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: N-[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Formula: C25H24ClN3O4S MolecularWeight: 497.99376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H24ClN3O4S/c1-17-22(26)10-5-11-23(17)28-24(30)15-27-25(31)19-8-4-9-21(14-19)34(32,33)29-13-12-18-6-2-3-7-20(18)16-29/h2-11,14H,12-13,15-16H2,1H3,(H,27,31)(H,28,30)