N-[3-oxidanylidene-3-[[3-(2-pyrazol-1-ylpropanoylamino)phenyl]amino]propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-oxidanylidene-3-[[3-(2-pyrazol-1-ylpropanoylamino)phenyl]amino]propyl]thiophene-3-carboxamide Openeye Name: N-[3-oxo-3-[3-(2-pyrazol-1-ylpropanoylamino)anilino]propyl]thiophene-3-carboxamide CAS Name: N-[3-oxo-3-[3-[[1-oxo-2-(1-pyrazolyl)propyl]amino]anilino]propyl]-3-thiophenecarboxamide IUPAC Name: N-[3-oxo-3-[3-(2-pyrazol-1-ylpropanoylamino)anilino]propyl]thiophene-3-carboxamide Traditional Name: N-[3-keto-3-[3-(2-pyrazol-1-ylpropanoylamino)anilino]propyl]thiophene-3-carboxamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)NC(=O)CCNC(=O)C2=CSC=C2)N3C=CC=N3

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)NC(=O)CCNC(=O)C2=CSC=C2)N3C=CC=N3

InChI

InChI=1S/C20H21N5O3S/c1-14(25-10-3-8-22-25)19(27)24-17-5-2-4-16(12-17)23-18(26)6-9-21-20(28)15-7-11-29-13-15/h2-5,7-8,10-14H,6,9H2,1H3,(H,21,28)(H,23,26)(H,24,27)