2-[[2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]-1-thiophen-2-yl-ethanone

Systemtic Name: 2-[[2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]-1-thiophen-2-yl-ethanone Openeye Name: 2-[[2-(m-tolyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]-1-(2-thienyl)ethanone CAS Name: 2-[[2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazolin-4-yl]thio]-1-thiophen-2-ylethanone IUPAC Name: 2-[[2-(3-methylphenyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]-1-thiophen-2-ylethanone Traditional Name: 2-[[2-(m-tolyl)-5,6,7,8-tetrahydroquinazolin-4-yl]thio]-1-(2-thienyl)ethanone Formula: C21H20N2OS2 MolecularWeight: 380.5263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=C(CCCC3)C(=N2)SCC(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=C(CCCC3)C(=N2)SCC(=O)C4=CC=CS4

InChI

InChI=1S/C21H20N2OS2/c1-14-6-4-7-15(12-14)20-22-17-9-3-2-8-16(17)21(23-20)26-13-18(24)19-10-5-11-25-19/h4-7,10-12H,2-3,8-9,13H2,1H3