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

Systemtic Name: 3-(2-methoxyethyl)-2-[(3-methylphenyl)methylsulfanyl]-4-oxidanylidene-N-propan-2-yl-quinazoline-7-carboxamide Openeye Name: N-isopropyl-3-(2-methoxyethyl)-2-(m-tolylmethylsulfanyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 3-(2-methoxyethyl)-2-[(3-methylphenyl)methylthio]-4-oxo-N-propan-2-yl-7-quinazolinecarboxamide IUPAC Name: 3-(2-methoxyethyl)-2-[(3-methylphenyl)methylsulfanyl]-4-oxo-N-propan-2-ylquinazoline-7-carboxamide Traditional Name: N-isopropyl-4-keto-3-(2-methoxyethyl)-2-[(3-methylbenzyl)thio]quinazoline-7-carboxamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NC3=C(C=CC(=C3)C(=O)NC(C)C)C(=O)N2CCOC

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NC3=C(C=CC(=C3)C(=O)NC(C)C)C(=O)N2CCOC

InChI

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