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

Systemtic Name: N-(2-methoxyethyl)-2-[(4-methylphenyl)methylsulfanyl]-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 3-isobutyl-N-(2-methoxyethyl)-4-oxo-2-(p-tolylmethylsulfanyl)quinazoline-7-carboxamide CAS Name: N-(2-methoxyethyl)-2-[(4-methylphenyl)methylthio]-3-(2-methylpropyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: N-(2-methoxyethyl)-2-[(4-methylphenyl)methylsulfanyl]-3-(2-methylpropyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 3-isobutyl-4-keto-N-(2-methoxyethyl)-2-[(4-methylbenzyl)thio]quinazoline-7-carboxamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)NCCOC)C(=O)N2CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)NCCOC)C(=O)N2CC(C)C

InChI

InChI=1S/C24H29N3O3S/c1-16(2)14-27-23(29)20-10-9-19(22(28)25-11-12-30-4)13-21(20)26-24(27)31-15-18-7-5-17(3)6-8-18/h5-10,13,16H,11-12,14-15H2,1-4H3,(H,25,28)