2-[3-(2,3-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2-methoxyphenyl)methyl]propanamide

Systemtic Name: 2-[3-(2,3-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2-methoxyphenyl)methyl]propanamide Openeye Name: 2-[3-(2,3-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(2-methoxyphenyl)methyl]propanamide CAS Name: 2-[[3-(2,3-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[(2-methoxyphenyl)methyl]propanamide IUPAC Name: 2-[3-(2,3-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(2-methoxyphenyl)methyl]propanamide Traditional Name: 2-[[3-(2,3-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-o-anisyl-propionamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NCC4=CC=CC=C4OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NCC4=CC=CC=C4OC)C

InChI

InChI=1S/C27H27N3O3S/c1-17-10-9-14-23(18(17)2)30-26(32)21-12-6-7-13-22(21)29-27(30)34-19(3)25(31)28-16-20-11-5-8-15-24(20)33-4/h5-15,19H,16H2,1-4H3,(H,28,31)