(2S)-2-[(2-acetamido-5-methyl-phenyl)sulfonylamino]-3-phenyl-N-(1,3-thiazol-4-ylmethyl)propanamide

Systemtic Name: (2S)-2-[(2-acetamido-5-methyl-phenyl)sulfonylamino]-3-phenyl-N-(1,3-thiazol-4-ylmethyl)propanamide Openeye Name: (2S)-2-[(2-acetamido-5-methyl-phenyl)sulfonylamino]-3-phenyl-N-(thiazol-4-ylmethyl)propanamide CAS Name: (2S)-2-[(2-acetamido-5-methylphenyl)sulfonylamino]-3-phenyl-N-(4-thiazolylmethyl)propanamide IUPAC Name: (2S)-2-[(2-acetamido-5-methylphenyl)sulfonylamino]-3-phenyl-N-(1,3-thiazol-4-ylmethyl)propanamide Traditional Name: (2S)-2-[(2-acetamido-5-methyl-phenyl)sulfonylamino]-3-phenyl-N-(thiazol-4-ylmethyl)propionamide Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NCC3=CSC=N3

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C)S(=O)(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCC3=CSC=N3

InChI

InChI=1S/C22H24N4O4S2/c1-15-8-9-19(25-16(2)27)21(10-15)32(29,30)26-20(11-17-6-4-3-5-7-17)22(28)23-12-18-13-31-14-24-18/h3-10,13-14,20,26H,11-12H2,1-2H3,(H,23,28)(H,25,27)/t20-/m0/s1