N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-morpholinosulfonyl-benzamide CAS Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-morpholinosulfonyl-benzamide Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H25N3O5S/c1-16(26)24-9-8-17-2-5-20(14-19(17)15-24)23-22(27)18-3-6-21(7-4-18)31(28,29)25-10-12-30-13-11-25/h2-7,14H,8-13,15H2,1H3,(H,23,27)