N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]-3-(1-phenylpyrazol-4-yl)propionamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H21ClN4O2/c1-15-18(22)8-5-9-19(15)25-21(28)13-23-20(27)11-10-16-12-24-26(14-16)17-6-3-2-4-7-17/h2-9,12,14H,10-11,13H2,1H3,(H,23,27)(H,25,28)