3-cyclopentyl-2-[2-(5-ethylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-cyclopentyl-2-[2-(5-ethylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-cyclopentyl-2-[2-(5-ethyl-2-thienyl)-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-cyclopentyl-2-[[2-(5-ethyl-2-thiophenyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-cyclopentyl-2-[2-(5-ethylthiophen-2-yl)-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-cyclopentyl-2-[[2-(5-ethyl-2-thienyl)-2-keto-ethyl]thio]quinazolin-4-one Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

Isomeric SMILES

CCC1=CC=C(S1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

InChI

InChI=1S/C21H22N2O2S2/c1-2-15-11-12-19(27-15)18(24)13-26-21-22-17-10-6-5-9-16(17)20(25)23(21)14-7-3-4-8-14/h5-6,9-12,14H,2-4,7-8,13H2,1H3