1,3-bis[3-(4-methylphenyl)-2-sulfanylidene-1,4-dihydroquinazolin-4-yl]propan-2-one

Systemtic Name: 1,3-bis[3-(4-methylphenyl)-2-sulfanylidene-1,4-dihydroquinazolin-4-yl]propan-2-one Openeye Name: 1,3-bis[3-(p-tolyl)-2-thioxo-1,4-dihydroquinazolin-4-yl]propan-2-one CAS Name: 1,3-bis[3-(4-methylphenyl)-2-sulfanylidene-1,4-dihydroquinazolin-4-yl]-2-propanone IUPAC Name: 1,3-bis[3-(4-methylphenyl)-2-sulfanylidene-1,4-dihydroquinazolin-4-yl]propan-2-one Traditional Name: 1,3-bis[3-(p-tolyl)-2-thioxo-1,4-dihydroquinazolin-4-yl]acetone Formula: C33H30N4OS2 MolecularWeight: 562.7475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C3=CC=CC=C3NC2=S)CC(=O)CC4C5=CC=CC=C5NC(=S)N4C6=CC=C(C=C6)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C3=CC=CC=C3NC2=S)CC(=O)CC4C5=CC=CC=C5NC(=S)N4C6=CC=C(C=C6)C

InChI

InChI=1S/C33H30N4OS2/c1-21-11-15-23(16-12-21)36-30(26-7-3-5-9-28(26)34-32(36)39)19-25(38)20-31-27-8-4-6-10-29(27)35-33(40)37(31)24-17-13-22(2)14-18-24/h3-18,30-31H,19-20H2,1-2H3,(H,34,39)(H,35,40)