N-[3-chloranyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[3-chloranyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[3-chloro-4-[(3-methylsulfonylbenzoyl)amino]phenyl]-2-phenyl-triazole-4-carboxamide CAS Name: N-[3-chloro-4-[[(3-methylsulfonylphenyl)-oxomethyl]amino]phenyl]-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[3-chloro-4-[(3-methylsulfonylbenzoyl)amino]phenyl]-2-phenyltriazole-4-carboxamide Traditional Name: N-[3-chloro-4-[(3-mesylbenzoyl)amino]phenyl]-2-phenyl-triazole-4-carboxamide Formula: C23H18ClN5O4S MolecularWeight: 495.93812

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H18ClN5O4S/c1-34(32,33)18-9-5-6-15(12-18)22(30)27-20-11-10-16(13-19(20)24)26-23(31)21-14-25-29(28-21)17-7-3-2-4-8-17/h2-14H,1H3,(H,26,31)(H,27,30)