4-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,4,5,6,7,8-hexahydroquinazoline-2-thione

Systemtic Name: 4-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,4,5,6,7,8-hexahydroquinazoline-2-thione Openeye Name: 4-(4-methoxyphenyl)-3-(p-tolylsulfonyl)-1,4,5,6,7,8-hexahydroquinazoline-2-thione CAS Name: 4-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,4,5,6,7,8-hexahydroquinazoline-2-thione IUPAC Name: 4-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonyl-1,4,5,6,7,8-hexahydroquinazoline-2-thione Traditional Name: 4-(4-methoxyphenyl)-3-tosyl-1,4,5,6,7,8-hexahydroquinazoline-2-thione Formula: C22H24N2O3S2 MolecularWeight: 428.56756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C3=C(CCCC3)NC2=S)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(C3=C(CCCC3)NC2=S)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H24N2O3S2/c1-15-7-13-18(14-8-15)29(25,26)24-21(16-9-11-17(27-2)12-10-16)19-5-3-4-6-20(19)23-22(24)28/h7-14,21H,3-6H2,1-2H3,(H,23,28)