N-[4-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-oxidanylidene-butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[(1,3-diphenyl-4-pyrazolyl)methylamino]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-keto-butyl]thiophene-2-carboxamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CCCNC(=O)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CCCNC(=O)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2S/c30-23(14-7-15-26-25(31)22-13-8-16-32-22)27-17-20-18-29(21-11-5-2-6-12-21)28-24(20)19-9-3-1-4-10-19/h1-6,8-13,16,18H,7,14-15,17H2,(H,26,31)(H,27,30)