(2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]butanamide

Systemtic Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]butanamide Openeye Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]butanamide CAS Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]butanamide IUPAC Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]butanamide Traditional Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-methyl-N-[4-(pyrazol-1-ylmethyl)benzyl]butyramide Formula: C22H25ClN4O3S MolecularWeight: 460.9769

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=C(C=C1)CN2C=CC=N2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=C(C=C1)CN2C=CC=N2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN4O3S/c1-16(2)21(26-31(29,30)20-10-8-19(23)9-11-20)22(28)24-14-17-4-6-18(7-5-17)15-27-13-3-12-25-27/h3-13,16,21,26H,14-15H2,1-2H3,(H,24,28)/t21-/m0/s1