4-(4-methyl-1,4-diazepan-1-yl)-N-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: 4-(4-methyl-1,4-diazepan-1-yl)-N-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: N-benzyl-4-(4-methyl-1,4-diazepan-1-yl)phthalazine-1-carboxamide CAS Name: 4-(4-methyl-1,4-diazepan-1-yl)-N-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: N-benzyl-4-(4-methyl-1,4-diazepan-1-yl)phthalazine-1-carboxamide Traditional Name: N-benzyl-4-(4-methyl-1,4-diazepan-1-yl)phthalazine-1-carboxamide Formula: C22H25N5O MolecularWeight: 375.4668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=NN=C(C3=CC=CC=C32)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CN1CCCN(CC1)C2=NN=C(C3=CC=CC=C32)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H25N5O/c1-26-12-7-13-27(15-14-26)21-19-11-6-5-10-18(19)20(24-25-21)22(28)23-16-17-8-3-2-4-9-17/h2-6,8-11H,7,12-16H2,1H3,(H,23,28)