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

Systemtic Name: 4-oxidanylidene-N-[1-oxidanylidene-1-(propylamino)propan-2-yl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[1-methyl-2-oxo-2-(propylamino)ethyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-N-[1-oxo-1-(propylamino)propan-2-yl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-N-[1-oxo-1-(propylamino)propan-2-yl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-4-keto-N-[2-keto-1-methyl-2-(propylamino)ethyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC=C

Isomeric SMILES

CCCNC(=O)C(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC=C

InChI

InChI=1S/C18H22N4O3S/c1-4-8-19-15(23)11(3)20-16(24)12-6-7-13-14(10-12)21-18(26)22(9-5-2)17(13)25/h5-7,10-11H,2,4,8-9H2,1,3H3,(H,19,23)(H,20,24)(H,21,26)