N-[2,5-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)pyrrol-1-yl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[2,5-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)pyrrol-1-yl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[2,5-dimethyl-3-(2-methylthiazol-4-yl)pyrrol-1-yl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[2,5-dimethyl-3-(2-methyl-4-thiazolyl)-1-pyrrolyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[2,5-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)pyrrol-1-yl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[2,5-dimethyl-3-(2-methylthiazol-4-yl)pyrrol-1-yl]-4-keto-3H-phthalazine-1-carboxamide Formula: C19H17N5O2S MolecularWeight: 379.43558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1NC(=O)C2=NNC(=O)C3=CC=CC=C32)C)C4=CSC(=N4)C

Isomeric SMILES

CC1=CC(=C(N1NC(=O)C2=NNC(=O)C3=CC=CC=C32)C)C4=CSC(=N4)C

InChI

InChI=1S/C19H17N5O2S/c1-10-8-15(16-9-27-12(3)20-16)11(2)24(10)23-19(26)17-13-6-4-5-7-14(13)18(25)22-21-17/h4-9H,1-3H3,(H,22,25)(H,23,26)