N-(cyclopropylmethyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide

Systemtic Name: N-(cyclopropylmethyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide Openeye Name: N-(cyclopropylmethyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide CAS Name: N-(cyclopropylmethyl)-4-[4-(4-methoxyphenyl)-1-piperazinyl]-1-phthalazinecarboxamide IUPAC Name: N-(cyclopropylmethyl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide Traditional Name: N-(cyclopropylmethyl)-4-[4-(4-methoxyphenyl)piperazino]phthalazine-1-carboxamide Formula: C24H27N5O2 MolecularWeight: 417.50348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCC5CC5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCC5CC5

InChI

InChI=1S/C24H27N5O2/c1-31-19-10-8-18(9-11-19)28-12-14-29(15-13-28)23-21-5-3-2-4-20(21)22(26-27-23)24(30)25-16-17-6-7-17/h2-5,8-11,17H,6-7,12-16H2,1H3,(H,25,30)