2-[(4-methylphenyl)methylsulfanyl]-4-piperidin-1-yl-5,6,7,8-tetrahydroquinazoline

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-4-piperidin-1-yl-5,6,7,8-tetrahydroquinazoline Openeye Name: 4-(1-piperidyl)-2-(p-tolylmethylsulfanyl)-5,6,7,8-tetrahydroquinazoline CAS Name: 2-[(4-methylphenyl)methylthio]-4-(1-piperidinyl)-5,6,7,8-tetrahydroquinazoline IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-4-piperidin-1-yl-5,6,7,8-tetrahydroquinazoline Traditional Name: 2-[(4-methylbenzyl)thio]-4-piperidino-5,6,7,8-tetrahydroquinazoline Formula: C21H27N3S MolecularWeight: 353.52418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(CCCC3)C(=N2)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(CCCC3)C(=N2)N4CCCCC4

InChI

InChI=1S/C21H27N3S/c1-16-9-11-17(12-10-16)15-25-21-22-19-8-4-3-7-18(19)20(23-21)24-13-5-2-6-14-24/h9-12H,2-8,13-15H2,1H3