N-[(2-methoxyphenyl)methyl]-4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)butanamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)butanamide Openeye Name: N-[(2-methoxyphenyl)methyl]-4-(4-oxo-2-thioxo-1H-quinazolin-3-yl)butanamide CAS Name: N-[(2-methoxyphenyl)methyl]-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)butanamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)butanamide Traditional Name: 4-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-o-anisyl-butyramide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)CCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)CCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C20H21N3O3S/c1-26-17-10-5-2-7-14(17)13-21-18(24)11-6-12-23-19(25)15-8-3-4-9-16(15)22-20(23)27/h2-5,7-10H,6,11-13H2,1H3,(H,21,24)(H,22,27)