4-oxidanylidene-3-(phenylmethyl)-N-(1-propylsulfonylpiperidin-4-yl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-(1-propylsulfonylpiperidin-4-yl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-(1-propylsulfonyl-4-piperidyl)phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-(1-propylsulfonyl-4-piperidinyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-(1-propylsulfonylpiperidin-4-yl)phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-(1-propylsulfonyl-4-piperidyl)phthalazine-1-carboxamide Formula: C24H28N4O4S MolecularWeight: 468.56852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O4S/c1-2-16-33(31,32)27-14-12-19(13-15-27)25-23(29)22-20-10-6-7-11-21(20)24(30)28(26-22)17-18-8-4-3-5-9-18/h3-11,19H,2,12-17H2,1H3,(H,25,29)