3-[(4-methylphenyl)sulfonyl-phenyl-amino]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide

Systemtic Name: 3-[(4-methylphenyl)sulfonyl-phenyl-amino]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide Openeye Name: 3-[N-(p-tolylsulfonyl)anilino]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide CAS Name: 3-(N-(4-methylphenyl)sulfonylanilino)-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]propanamide IUPAC Name: 3-(N-(4-methylphenyl)sulfonylanilino)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide Traditional Name: N-[2-(4-pyrazol-1-ylphenyl)ethyl]-3-(N-tosylanilino)propionamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NCCC2=CC=C(C=C2)N3C=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NCCC2=CC=C(C=C2)N3C=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4O3S/c1-22-8-14-26(15-9-22)35(33,34)31(25-6-3-2-4-7-25)21-17-27(32)28-19-16-23-10-12-24(13-11-23)30-20-5-18-29-30/h2-15,18,20H,16-17,19,21H2,1H3,(H,28,32)