N-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)amino]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)amino]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-4-keto-butyl]thiophene-3-carboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C20H22N4O2S/c1-14-19(15(2)24(23-14)17-7-4-3-5-8-17)22-18(25)9-6-11-21-20(26)16-10-12-27-13-16/h3-5,7-8,10,12-13H,6,9,11H2,1-2H3,(H,21,26)(H,22,25)