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

Systemtic Name: N-[2-(diethylamino)-2-phenyl-ethyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[2-(diethylamino)-2-phenyl-ethyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[2-(diethylamino)-2-phenylethyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[2-(diethylamino)-2-phenylethyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-[2-(diethylamino)-2-phenyl-ethyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC=C)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC=C)C3=CC=CC=C3

InChI

InChI=1S/C24H28N4O2S/c1-4-14-28-23(30)19-13-12-18(15-20(19)26-24(28)31)22(29)25-16-21(27(5-2)6-3)17-10-8-7-9-11-17/h4,7-13,15,21H,1,5-6,14,16H2,2-3H3,(H,25,29)(H,26,31)