N-[[2-methyl-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[2-methyl-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenyl]methyl]thiophene-2-carboxamide Openeye Name: N-[[2-methyl-5-(3-methyl-4-oxo-phthalazin-1-yl)phenyl]methyl]thiophene-2-carboxamide CAS Name: N-[[2-methyl-5-(3-methyl-4-oxo-1-phthalazinyl)phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)phenyl]methyl]thiophene-2-carboxamide Traditional Name: N-[5-(4-keto-3-methyl-phthalazin-1-yl)-2-methyl-benzyl]thiophene-2-carboxamide Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C)CNC(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C)CNC(=O)C4=CC=CS4

InChI

InChI=1S/C22H19N3O2S/c1-14-9-10-15(12-16(14)13-23-21(26)19-8-5-11-28-19)20-17-6-3-4-7-18(17)22(27)25(2)24-20/h3-12H,13H2,1-2H3,(H,23,26)