2-(aminocarbonylamino)-N-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-4-methylsulfanyl-butanamide

Systemtic Name: 2-(aminocarbonylamino)-N-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-4-methylsulfanyl-butanamide Openeye Name: N-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-4-methylsulfanyl-2-ureido-butanamide CAS Name: 2-(carbamoylamino)-N-[[3-(3,4-dimethylphenyl)-1-phenyl-4-pyrazolyl]methyl]-N-methyl-4-(methylthio)butanamide IUPAC Name: 2-(carbamoylamino)-N-[[3-(3,4-dimethylphenyl)-1-phenylpyrazol-4-yl]methyl]-N-methyl-4-methylsulfanylbutanamide Traditional Name: N-[[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-4-(methylthio)-2-ureido-butyramide Formula: C25H31N5O2S MolecularWeight: 465.61094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2CN(C)C(=O)C(CCSC)NC(=O)N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2CN(C)C(=O)C(CCSC)NC(=O)N)C3=CC=CC=C3)C

InChI

InChI=1S/C25H31N5O2S/c1-17-10-11-19(14-18(17)2)23-20(16-30(28-23)21-8-6-5-7-9-21)15-29(3)24(31)22(12-13-33-4)27-25(26)32/h5-11,14,16,22H,12-13,15H2,1-4H3,(H3,26,27,32)