1-[(3S)-3-(3-methyl-1-phenyl-pyrazol-4-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[(3S)-3-(3-methyl-1-phenyl-pyrazol-4-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3S)-3-(3-methyl-1-phenyl-pyrazol-4-yl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3S)-3-(3-methyl-1-phenyl-4-pyrazolyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3S)-3-(3-methyl-1-phenylpyrazol-4-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5S)-5-(3-methyl-1-phenyl-pyrazol-4-yl)-3-(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C19H18N4OS MolecularWeight: 350.43742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2CC(=NN2C(=O)C)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C=C1[C@@H]2CC(=NN2C(=O)C)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C19H18N4OS/c1-13-16(12-22(20-13)15-7-4-3-5-8-15)18-11-17(19-9-6-10-25-19)21-23(18)14(2)24/h3-10,12,18H,11H2,1-2H3/t18-/m0/s1