N-[3-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]phenyl]-2-pyrazol-1-yl-propanamide

Systemtic Name: N-[3-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]phenyl]-2-pyrazol-1-yl-propanamide Openeye Name: N-[3-[[2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylacetyl]amino]phenyl]-2-pyrazol-1-yl-propanamide CAS Name: N-[3-[[2-[[2-(3-methylanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]phenyl]-2-(1-pyrazolyl)propanamide IUPAC Name: N-[3-[[2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetyl]amino]phenyl]-2-pyrazol-1-ylpropanamide Traditional Name: N-[3-[[2-[[2-keto-2-(m-toluidino)ethyl]thio]acetyl]amino]phenyl]-2-pyrazol-1-yl-propionamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=CC(=CC=C2)NC(=O)C(C)N3C=CC=N3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=CC(=CC=C2)NC(=O)C(C)N3C=CC=N3

InChI

InChI=1S/C23H25N5O3S/c1-16-6-3-7-18(12-16)25-21(29)14-32-15-22(30)26-19-8-4-9-20(13-19)27-23(31)17(2)28-11-5-10-24-28/h3-13,17H,14-15H2,1-2H3,(H,25,29)(H,26,30)(H,27,31)