N-[4-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethylamino]-4-oxidanylidene-butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethylamino]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethylamino]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[2-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]ethylamino]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethylamino]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethylamino]-4-keto-butyl]thiophene-2-carboxamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)CCNC(=O)CCCNC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)CCNC(=O)CCCNC(=O)C3=CC=CS3)C

InChI

InChI=1S/C22H26N4O2S/c1-16-15-17(2)26(25-16)19-9-7-18(8-10-19)11-13-23-21(27)6-3-12-24-22(28)20-5-4-14-29-20/h4-5,7-10,14-15H,3,6,11-13H2,1-2H3,(H,23,27)(H,24,28)