3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-ethyl-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-ethyl-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-ethyl-N-[2-(isopropylamino)-2-oxo-ethyl]benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-ethyl-N-[2-(isopropylamino)-2-keto-ethyl]benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O4S/c1-4-25(16-22(27)24-17(2)3)23(28)19-10-7-11-21(14-19)31(29,30)26-13-12-18-8-5-6-9-20(18)15-26/h5-11,14,17H,4,12-13,15-16H2,1-3H3,(H,24,27)