N-(2-benzamidoethyl)-4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide

Systemtic Name: N-(2-benzamidoethyl)-4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: N-(2-benzamidoethyl)-4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide CAS Name: N-(2-benzamidoethyl)-4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: N-(2-benzamidoethyl)-4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: N-(2-benzamidoethyl)-4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Formula: C25H24ClN3O4S MolecularWeight: 497.99376

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NCCNC(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NCCNC(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H24ClN3O4S/c26-22-11-10-20(25(31)28-14-13-27-24(30)19-7-2-1-3-8-19)16-23(22)34(32,33)29-15-12-18-6-4-5-9-21(18)17-29/h1-11,16H,12-15,17H2,(H,27,30)(H,28,31)