(E)-2-[5-chloranyl-4-(3-methyl-1-phenyl-5-sulfanylidene-4H-pyrazol-4-yl)-1-phenyl-pyrazol-3-yl]-3-(dimethylamino)prop-2-enal

Systemtic Name: (E)-2-[5-chloranyl-4-(3-methyl-1-phenyl-5-sulfanylidene-4H-pyrazol-4-yl)-1-phenyl-pyrazol-3-yl]-3-(dimethylamino)prop-2-enal Openeye Name: (E)-2-[5-chloro-4-(3-methyl-1-phenyl-5-thioxo-4H-pyrazol-4-yl)-1-phenyl-pyrazol-3-yl]-3-(dimethylamino)prop-2-enal CAS Name: (E)-2-[5-chloro-4-(3-methyl-1-phenyl-5-sulfanylidene-4H-pyrazol-4-yl)-1-phenyl-3-pyrazolyl]-3-(dimethylamino)-2-propenal IUPAC Name: (E)-2-[5-chloro-4-(3-methyl-1-phenyl-5-sulfanylidene-4H-pyrazol-4-yl)-1-phenylpyrazol-3-yl]-3-(dimethylamino)prop-2-enal Traditional Name: (E)-2-[5-chloro-4-(3-methyl-1-phenyl-5-thioxo-2-pyrazolin-4-yl)-1-phenyl-pyrazol-3-yl]-3-(dimethylamino)acrolein Formula: C24H22ClN5OS MolecularWeight: 463.98238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)C1C2=C(N(N=C2C(=CN(C)C)C=O)C3=CC=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=S)C1C2=C(N(N=C2/C(=C\N(C)C)/C=O)C3=CC=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C24H22ClN5OS/c1-16-20(24(32)30(26-16)19-12-8-5-9-13-19)21-22(17(15-31)14-28(2)3)27-29(23(21)25)18-10-6-4-7-11-18/h4-15,20H,1-3H3/b17-14-