3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxidanylidene-ethyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxidanylidene-ethyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxo-ethyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[2-(4-cyclohexyl-1-piperazinyl)-2-oxoethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[2-(4-cyclohexylpiperazino)-2-keto-ethyl]-2-thioxo-1H-quinazolin-4-one Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C20H26N4O2S/c25-18(23-12-10-22(11-13-23)15-6-2-1-3-7-15)14-24-19(26)16-8-4-5-9-17(16)21-20(24)27/h4-5,8-9,15H,1-3,6-7,10-14H2,(H,21,27)