N-(5,6-dihydrobenzo[h]quinazolin-2-yl)-2-(4-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(5,6-dihydrobenzo[h]quinazolin-2-yl)-2-(4-methylphenyl)sulfanyl-ethanamide Openeye Name: N-(5,6-dihydrobenzo[h]quinazolin-2-yl)-2-(p-tolylsulfanyl)acetamide CAS Name: N-(5,6-dihydrobenzo[h]quinazolin-2-yl)-2-[(4-methylphenyl)thio]acetamide IUPAC Name: N-(5,6-dihydrobenzo[h]quinazolin-2-yl)-2-(4-methylphenyl)sulfanylacetamide Traditional Name: N-(5,6-dihydrobenzo[h]quinazolin-2-yl)-2-(p-tolylthio)acetamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=NC=C3CCC4=CC=CC=C4C3=N2

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=NC=C3CCC4=CC=CC=C4C3=N2

InChI

InChI=1S/C21H19N3OS/c1-14-6-10-17(11-7-14)26-13-19(25)23-21-22-12-16-9-8-15-4-2-3-5-18(15)20(16)24-21/h2-7,10-12H,8-9,13H2,1H3,(H,22,23,24,25)