1-[4-(1,6-dimethyl-2-oxidanylidene-quinolin-4-yl)sulfanylphenyl]-3-(4-methylphenyl)thiourea

Systemtic Name: 1-[4-(1,6-dimethyl-2-oxidanylidene-quinolin-4-yl)sulfanylphenyl]-3-(4-methylphenyl)thiourea Openeye Name: 1-[4-[(1,6-dimethyl-2-oxo-4-quinolyl)sulfanyl]phenyl]-3-(p-tolyl)thiourea CAS Name: 1-[4-[(1,6-dimethyl-2-oxo-4-quinolinyl)thio]phenyl]-3-(4-methylphenyl)thiourea IUPAC Name: 1-[4-(1,6-dimethyl-2-oxoquinolin-4-yl)sulfanylphenyl]-3-(4-methylphenyl)thiourea Traditional Name: 1-[4-[(2-keto-1,6-dimethyl-4-quinolyl)thio]phenyl]-3-(p-tolyl)thiourea Formula: C25H23N3OS2 MolecularWeight: 445.59962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)SC3=CC(=O)N(C4=C3C=C(C=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)SC3=CC(=O)N(C4=C3C=C(C=C4)C)C

InChI

InChI=1S/C25H23N3OS2/c1-16-4-7-18(8-5-16)26-25(30)27-19-9-11-20(12-10-19)31-23-15-24(29)28(3)22-13-6-17(2)14-21(22)23/h4-15H,1-3H3,(H2,26,27,30)