N-[1-(2,4-dichlorophenyl)ethyl]-N-methyl-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[1-(2,4-dichlorophenyl)ethyl]-N-methyl-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[1-(2,4-dichlorophenyl)ethyl]-N-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[1-(2,4-dichlorophenyl)ethyl]-N-methyl-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[1-(2,4-dichlorophenyl)ethyl]-N-methyl-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-[1-(2,4-dichlorophenyl)ethyl]-4-keto-N-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H19Cl2N3O2S MolecularWeight: 448.36546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)Cl)Cl)N(C)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

CC(C1=C(C=C(C=C1)Cl)Cl)N(C)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C21H19Cl2N3O2S/c1-4-9-26-20(28)16-7-5-13(10-18(16)24-21(26)29)19(27)25(3)12(2)15-8-6-14(22)11-17(15)23/h4-8,10-12H,1,9H2,2-3H3,(H,24,29)