6,7-diethoxy-3-[3-[ethyl(phenyl)amino]propyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6,7-diethoxy-3-[3-[ethyl(phenyl)amino]propyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6,7-diethoxy-3-[3-(N-ethylanilino)propyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 6,7-diethoxy-3-[3-(N-ethylanilino)propyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6,7-diethoxy-3-[3-(N-ethylanilino)propyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6,7-diethoxy-3-[3-(N-ethylanilino)propyl]-2-thioxo-1H-quinazolin-4-one Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCN1C(=O)C2=CC(=C(C=C2NC1=S)OCC)OCC)C3=CC=CC=C3

Isomeric SMILES

CCN(CCCN1C(=O)C2=CC(=C(C=C2NC1=S)OCC)OCC)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3S/c1-4-25(17-11-8-7-9-12-17)13-10-14-26-22(27)18-15-20(28-5-2)21(29-6-3)16-19(18)24-23(26)30/h7-9,11-12,15-16H,4-6,10,13-14H2,1-3H3,(H,24,30)