2-[2-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[2-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide Openeye Name: 2-[2-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-2-oxo-ethyl]sulfanyl-N-(m-tolyl)acetamide CAS Name: 2-[[2-[(1,3-diphenyl-4-pyrazolyl)methyl-methylamino]-2-oxoethyl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[2-[(1,3-diphenylpyrazol-4-yl)methyl-methylamino]-2-oxoethyl]sulfanyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[[2-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-2-keto-ethyl]thio]-N-(m-tolyl)acetamide Formula: C28H28N4O2S MolecularWeight: 484.61252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H28N4O2S/c1-21-10-9-13-24(16-21)29-26(33)19-35-20-27(34)31(2)17-23-18-32(25-14-7-4-8-15-25)30-28(23)22-11-5-3-6-12-22/h3-16,18H,17,19-20H2,1-2H3,(H,29,33)