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

Systemtic Name: N-cyclopentyl-2-[[2-oxidanylidene-1-(pyridin-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]ethanamide Openeye Name: N-cyclopentyl-2-[[2-oxo-1-(2-pyridylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]acetamide CAS Name: N-cyclopentyl-2-[[2-oxo-1-(2-pyridinylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]thio]acetamide IUPAC Name: N-cyclopentyl-2-[[2-oxo-1-(pyridin-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]acetamide Traditional Name: N-cyclopentyl-2-[[2-keto-1-(2-pyridylmethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]thio]acetamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CSC2=NC(=O)N(C3=C2CCCC3)CC4=CC=CC=N4

Isomeric SMILES

C1CCC(C1)NC(=O)CSC2=NC(=O)N(C3=C2CCCC3)CC4=CC=CC=N4

InChI

InChI=1S/C21H26N4O2S/c26-19(23-15-7-1-2-8-15)14-28-20-17-10-3-4-11-18(17)25(21(27)24-20)13-16-9-5-6-12-22-16/h5-6,9,12,15H,1-4,7-8,10-11,13-14H2,(H,23,26)