2-[3-[2-(cyclohexen-1-yl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-ethyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[3-[2-(cyclohexen-1-yl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-ethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[3-[2-(cyclohexen-1-yl)ethyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-ethyl-acetamide CAS Name: 2-[[3-[2-(1-cyclohexenyl)ethyl]-4-oxo-2-quinazolinyl]thio]-N-ethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-[2-(cyclohexen-1-yl)ethyl]-4-oxoquinazolin-2-yl]sulfanyl-N-ethylacetamide Traditional Name: N-benzyl-2-[[3-[2-(cyclohexen-1-yl)ethyl]-4-keto-quinazolin-2-yl]thio]-N-ethyl-acetamide Formula: C27H31N3O2S MolecularWeight: 461.61894

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CCCCC4

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CCCCC4

InChI

InChI=1S/C27H31N3O2S/c1-2-29(19-22-13-7-4-8-14-22)25(31)20-33-27-28-24-16-10-9-15-23(24)26(32)30(27)18-17-21-11-5-3-6-12-21/h4,7-11,13-16H,2-3,5-6,12,17-20H2,1H3