N-[2-[[ethanoyl(methyl)amino]methyl]phenyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[2-[[ethanoyl(methyl)amino]methyl]phenyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[2-[[acetyl(methyl)amino]methyl]phenyl]-3-allyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[2-[[acetyl(methyl)amino]methyl]phenyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[2-[[acetyl(methyl)amino]methyl]phenyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[2-[[acetyl(methyl)amino]methyl]phenyl]-3-allyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)CC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

CC(=O)N(C)CC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C22H22N4O3S/c1-4-11-26-21(29)17-10-9-15(12-19(17)24-22(26)30)20(28)23-18-8-6-5-7-16(18)13-25(3)14(2)27/h4-10,12H,1,11,13H2,2-3H3,(H,23,28)(H,24,30)