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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

InChI

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