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

Systemtic Name: N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[3-[2-(ethylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[3-[2-(ethylamino)-4-thiazolyl]-2,5-dimethyl-1-pyrrolyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]-2,5-dimethylpyrrol-1-yl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[3-[2-(ethylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]-4-keto-3H-phthalazine-1-carboxamide Formula: C20H20N6O2S MolecularWeight: 408.4768

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=CS1)C2=C(N(C(=C2)C)NC(=O)C3=NNC(=O)C4=CC=CC=C43)C

Isomeric SMILES

CCNC1=NC(=CS1)C2=C(N(C(=C2)C)NC(=O)C3=NNC(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C20H20N6O2S/c1-4-21-20-22-16(10-29-20)15-9-11(2)26(12(15)3)25-19(28)17-13-7-5-6-8-14(13)18(27)24-23-17/h5-10H,4H2,1-3H3,(H,21,22)(H,24,27)(H,25,28)