N-[1-[2-[methyl(1-thiophen-2-ylethyl)amino]-2-oxidanylidene-ethyl]pyrazol-4-yl]-3-phenoxy-propanamide

Systemtic Name: N-[1-[2-[methyl(1-thiophen-2-ylethyl)amino]-2-oxidanylidene-ethyl]pyrazol-4-yl]-3-phenoxy-propanamide Openeye Name: N-[1-[2-[methyl-[1-(2-thienyl)ethyl]amino]-2-oxo-ethyl]pyrazol-4-yl]-3-phenoxy-propanamide CAS Name: N-[1-[2-[methyl(1-thiophen-2-ylethyl)amino]-2-oxoethyl]-4-pyrazolyl]-3-phenoxypropanamide IUPAC Name: N-[1-[2-[methyl(1-thiophen-2-ylethyl)amino]-2-oxoethyl]pyrazol-4-yl]-3-phenoxypropanamide Traditional Name: N-[1-[2-keto-2-[methyl-[1-(2-thienyl)ethyl]amino]ethyl]pyrazol-4-yl]-3-phenoxy-propionamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)N(C)C(=O)CN2C=C(C=N2)NC(=O)CCOC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CS1)N(C)C(=O)CN2C=C(C=N2)NC(=O)CCOC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3S/c1-16(19-9-6-12-29-19)24(2)21(27)15-25-14-17(13-22-25)23-20(26)10-11-28-18-7-4-3-5-8-18/h3-9,12-14,16H,10-11,15H2,1-2H3,(H,23,26)