3-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C16H15N5O3S MolecularWeight: 357.387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)C

InChI

InChI=1S/C16H15N5O3S/c1-8-9(2)25-16(18-8)19-12(22)7-21-15(24)11-6-4-3-5-10(11)13(20-21)14(17)23/h3-6H,7H2,1-2H3,(H2,17,23)(H,18,19,22)