N-[[4-(aminocarbonylamino)phenyl]methyl]-2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide

Systemtic Name: N-[[4-(aminocarbonylamino)phenyl]methyl]-2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(4-ureidophenyl)methyl]benzamide CAS Name: N-[[4-(carbamoylamino)phenyl]methyl]-2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: N-[[4-(carbamoylamino)phenyl]methyl]-2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-ureidobenzyl)benzamide Formula: C24H23ClN4O4S MolecularWeight: 498.98182

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)NCC4=CC=C(C=C4)NC(=O)N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)NCC4=CC=C(C=C4)NC(=O)N

InChI

InChI=1S/C24H23ClN4O4S/c25-22-10-9-20(34(32,33)29-12-11-17-3-1-2-4-18(17)15-29)13-21(22)23(30)27-14-16-5-7-19(8-6-16)28-24(26)31/h1-10,13H,11-12,14-15H2,(H,27,30)(H3,26,28,31)