N-(2-methoxyethyl)-3-(4-methylphenyl)sulfanyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]propanamide

Systemtic Name: N-(2-methoxyethyl)-3-(4-methylphenyl)sulfanyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]propanamide Openeye Name: N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-(p-tolylsulfanyl)propanamide CAS Name: N-(2-methoxyethyl)-3-[(4-methylphenyl)thio]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide IUPAC Name: N-(2-methoxyethyl)-3-(4-methylphenyl)sulfanyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide Traditional Name: N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-(2-methoxyethyl)-3-(p-tolylthio)propionamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)N(CCOC)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)N(CCOC)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C22H25N3O3S/c1-16-7-9-17(10-8-16)29-14-11-21(26)25(12-13-28-2)15-20-23-19-6-4-3-5-18(19)22(27)24-20/h3-10H,11-15H2,1-2H3,(H,23,24,27)