N-[3-[ethyl(phenyl)amino]propyl]-3-(furan-2-ylmethyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[3-[ethyl(phenyl)amino]propyl]-3-(furan-2-ylmethyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[3-(N-ethylanilino)propyl]-3-(2-furylmethyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[3-(N-ethylanilino)propyl]-3-(2-furanylmethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[3-(N-ethylanilino)propyl]-3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[3-(N-ethylanilino)propyl]-3-(2-furfuryl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

CCN(CCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3S/c1-2-28(19-8-4-3-5-9-19)14-7-13-26-23(30)18-11-12-21-22(16-18)27-25(33)29(24(21)31)17-20-10-6-15-32-20/h3-6,8-12,15-16H,2,7,13-14,17H2,1H3,(H,26,30)(H,27,33)