N-cyclohexyl-2-[[2-oxidanylidene-1-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]ethanamide

Systemtic Name: N-cyclohexyl-2-[[2-oxidanylidene-1-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]ethanamide Openeye Name: N-cyclohexyl-2-[[2-oxo-1-(4-pyridylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]acetamide CAS Name: N-cyclohexyl-2-[[2-oxo-1-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[[2-oxo-1-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]acetamide Traditional Name: N-cyclohexyl-2-[[2-keto-1-(4-pyridylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]thio]acetamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=NC(=O)N(C3=C2CCCC3)CC4=CC=NC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=NC(=O)N(C3=C2CCCC3)CC4=CC=NC=C4

InChI

InChI=1S/C22H28N4O2S/c27-20(24-17-6-2-1-3-7-17)15-29-21-18-8-4-5-9-19(18)26(22(28)25-21)14-16-10-12-23-13-11-16/h10-13,17H,1-9,14-15H2,(H,24,27)