ethyl 2-[2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl-phenyl-amino]ethanoate

Systemtic Name: ethyl 2-[2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl-phenyl-amino]ethanoate Openeye Name: ethyl 2-(N-[2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]anilino)acetate CAS Name: 2-(N-[2-[(3-methyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]anilino)acetic acid ethyl ester IUPAC Name: ethyl 2-(N-[2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetyl]anilino)acetate Traditional Name: 2-(N-[2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetyl]anilino)acetic acid ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CCOC(=O)CN(C1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C21H21N3O4S/c1-3-28-19(26)13-24(15-9-5-4-6-10-15)18(25)14-29-21-22-17-12-8-7-11-16(17)20(27)23(21)2/h4-12H,3,13-14H2,1-2H3