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

Systemtic Name: 3-(2,3-dimethylphenyl)-4-oxidanylidene-N-(3-propan-2-yloxypropyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(2,3-dimethylphenyl)-N-(3-isopropoxypropyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(2,3-dimethylphenyl)-4-oxo-N-(3-propan-2-yloxypropyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(2,3-dimethylphenyl)-4-oxo-N-(3-propan-2-yloxypropyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(2,3-dimethylphenyl)-N-(3-isopropoxypropyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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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)NCCCOC(C)C)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCCCOC(C)C)NC2=S)C

InChI

InChI=1S/C23H27N3O3S/c1-14(2)29-12-6-11-24-21(27)17-9-10-18-19(13-17)25-23(30)26(22(18)28)20-8-5-7-15(3)16(20)4/h5,7-10,13-14H,6,11-12H2,1-4H3,(H,24,27)(H,25,30)