N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-1-phenyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2S/c1-3-11-21-19(25)14(2)22-20(26)16-13-24(15-8-5-4-6-9-15)23-18(16)17-10-7-12-27-17/h4-10,12-14H,3,11H2,1-2H3,(H,21,25)(H,22,26)/t14-/m0/s1