3-(3,5-dimethylphenyl)-N-(2-methoxyethyl)-2-[(2-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: 3-(3,5-dimethylphenyl)-N-(2-methoxyethyl)-2-[(2-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 3-(3,5-dimethylphenyl)-N-(2-methoxyethyl)-2-(o-tolylmethylsulfanyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 3-(3,5-dimethylphenyl)-N-(2-methoxyethyl)-2-[(2-methylphenyl)methylthio]-4-oxo-7-quinazolinecarboxamide IUPAC Name: 3-(3,5-dimethylphenyl)-N-(2-methoxyethyl)-2-[(2-methylphenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxamide Traditional Name: 3-(3,5-dimethylphenyl)-4-keto-N-(2-methoxyethyl)-2-[(2-methylbenzyl)thio]quinazoline-7-carboxamide Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C=CC(=C3)C(=O)NCCOC)C(=O)N2C4=CC(=CC(=C4)C)C

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C=CC(=C3)C(=O)NCCOC)C(=O)N2C4=CC(=CC(=C4)C)C

InChI

InChI=1S/C28H29N3O3S/c1-18-13-19(2)15-23(14-18)31-27(33)24-10-9-21(26(32)29-11-12-34-4)16-25(24)30-28(31)35-17-22-8-6-5-7-20(22)3/h5-10,13-16H,11-12,17H2,1-4H3,(H,29,32)