N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3-dimethylphenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3-dimethylphenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3-dimethylphenyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3-dimethylphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3-dimethylphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3-dimethylphenyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C25H21N3O4S MolecularWeight: 459.51694

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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=CC5=C(C=C4)OCCO5)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC5=C(C=C4)OCCO5)NC2=S)C

InChI

InChI=1S/C25H21N3O4S/c1-14-4-3-5-20(15(14)2)28-24(30)18-8-6-16(12-19(18)27-25(28)33)23(29)26-17-7-9-21-22(13-17)32-11-10-31-21/h3-9,12-13H,10-11H2,1-2H3,(H,26,29)(H,27,33)