N-[4-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[[5-methyl-2-(p-tolyl)pyrazol-3-yl]amino]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[[5-methyl-2-(4-methylphenyl)-3-pyrazolyl]amino]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-keto-4-[[5-methyl-2-(p-tolyl)pyrazol-3-yl]amino]butyl]thiophene-3-carboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C20H22N4O2S/c1-14-5-7-17(8-6-14)24-18(12-15(2)23-24)22-19(25)4-3-10-21-20(26)16-9-11-27-13-16/h5-9,11-13H,3-4,10H2,1-2H3,(H,21,26)(H,22,25)