N-(1-cyanocyclohexyl)-2-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-[3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[[3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-methylacetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-methylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[[4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-methyl-acetamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCOC)C3(CCCCC3)C#N

Isomeric SMILES

CN(C(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCOC)C3(CCCCC3)C#N

InChI

InChI=1S/C21H26N4O3S/c1-24(21(15-22)10-6-3-7-11-21)18(26)14-29-20-23-17-9-5-4-8-16(17)19(27)25(20)12-13-28-2/h4-5,8-9H,3,6-7,10-14H2,1-2H3