(4Z)-5-[(4-methylphenyl)sulfanylmethyl]-2-phenyl-4-[(1-prop-2-enyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]pyrazol-3-one

Systemtic Name: (4Z)-5-[(4-methylphenyl)sulfanylmethyl]-2-phenyl-4-[(1-prop-2-enyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]pyrazol-3-one Openeye Name: (4Z)-4-[(1-allyl-3,4-dihydro-2H-quinolin-6-yl)methylene]-2-phenyl-5-(p-tolylsulfanylmethyl)pyrazol-3-one CAS Name: (4Z)-5-[[(4-methylphenyl)thio]methyl]-2-phenyl-4-[(1-prop-2-enyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]-3-pyrazolone IUPAC Name: (4Z)-5-[(4-methylphenyl)sulfanylmethyl]-2-phenyl-4-[(1-prop-2-enyl-3,4-dihydro-2H-quinolin-6-yl)methylidene]pyrazol-3-one Traditional Name: (4Z)-4-[(1-allyl-3,4-dihydro-2H-quinolin-6-yl)methylene]-2-phenyl-5-[(p-tolylthio)methyl]-2-pyrazolin-3-one Formula: C30H29N3OS MolecularWeight: 479.63576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=NN(C(=O)C2=CC3=CC4=C(C=C3)N(CCC4)CC=C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)SCC\2=NN(C(=O)/C2=C\C3=CC4=C(C=C3)N(CCC4)CC=C)C5=CC=CC=C5

InChI

InChI=1S/C30H29N3OS/c1-3-17-32-18-7-8-24-19-23(13-16-29(24)32)20-27-28(21-35-26-14-11-22(2)12-15-26)31-33(30(27)34)25-9-5-4-6-10-25/h3-6,9-16,19-20H,1,7-8,17-18,21H2,2H3/b27-20-