4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pentan-3-yl-benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pentan-3-yl-benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1-ethylpropyl)benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pentan-3-ylbenzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pentan-3-ylbenzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1-ethylpropyl)benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCC(CC)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C21H26N2O3S/c1-3-19(4-2)22-21(24)17-9-11-20(12-10-17)27(25,26)23-14-13-16-7-5-6-8-18(16)15-23/h5-12,19H,3-4,13-15H2,1-2H3,(H,22,24)