3-(2,3-dimethylphenyl)-4-oxidanylidene-N-(3-pyrazin-2-yloxyphenyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(2,3-dimethylphenyl)-4-oxidanylidene-N-(3-pyrazin-2-yloxyphenyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(2,3-dimethylphenyl)-4-oxo-N-(3-pyrazin-2-yloxyphenyl)-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(2,3-dimethylphenyl)-4-oxo-N-[3-(2-pyrazinyloxy)phenyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(2,3-dimethylphenyl)-4-oxo-N-(3-pyrazin-2-yloxyphenyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(2,3-dimethylphenyl)-4-keto-N-(3-pyrazin-2-yloxyphenyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C27H21N5O3S MolecularWeight: 495.55234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC(=CC=C4)OC5=NC=CN=C5)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC(=CC=C4)OC5=NC=CN=C5)NC2=S)C

InChI

InChI=1S/C27H21N5O3S/c1-16-5-3-8-23(17(16)2)32-26(34)21-10-9-18(13-22(21)31-27(32)36)25(33)30-19-6-4-7-20(14-19)35-24-15-28-11-12-29-24/h3-15H,1-2H3,(H,30,33)(H,31,36)