N-[1-(1-benzofuran-2-yl)ethyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[1-(1-benzofuran-2-yl)ethyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[1-(benzofuran-2-yl)ethyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[1-(2-benzofuranyl)ethyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[1-(1-benzofuran-2-yl)ethyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-[1-(benzofuran-2-yl)ethyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC=C

Isomeric SMILES

CC(C1=CC2=CC=CC=C2O1)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC=C

InChI

InChI=1S/C22H19N3O3S/c1-3-10-25-21(27)16-9-8-15(11-17(16)24-22(25)29)20(26)23-13(2)19-12-14-6-4-5-7-18(14)28-19/h3-9,11-13H,1,10H2,2H3,(H,23,26)(H,24,29)