N-[4-[(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propanamide

Systemtic Name: N-[4-[(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propanamide Openeye Name: N-[4-[(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propanamide CAS Name: N-[4-[[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]propanamide IUPAC Name: N-[4-[(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propanamide Traditional Name: N-[4-[(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]propionamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)CC)C=C2

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)CC)C=C2

InChI

InChI=1S/C21H25N3O4S/c1-3-20(25)22-17-7-9-19(10-8-17)29(27,28)23-18-6-5-15-11-12-24(21(26)4-2)14-16(15)13-18/h5-10,13,23H,3-4,11-12,14H2,1-2H3,(H,22,25)