N-(6-acetamido-1,3-benzothiazol-2-yl)-5-(4-chlorophenyl)-1H-pyrazole-4-carboxamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-5-(4-chlorophenyl)-1H-pyrazole-4-carboxamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-5-(4-chlorophenyl)-1H-pyrazole-4-carboxamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-5-(4-chlorophenyl)-1H-pyrazole-4-carboxamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-5-(4-chlorophenyl)-1H-pyrazole-4-carboxamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-5-(4-chlorophenyl)-1H-pyrazole-4-carboxamide Formula: C19H14ClN5O2S MolecularWeight: 411.86476

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(NN=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(NN=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H14ClN5O2S/c1-10(26)22-13-6-7-15-16(8-13)28-19(23-15)24-18(27)14-9-21-25-17(14)11-2-4-12(20)5-3-11/h2-9H,1H3,(H,21,25)(H,22,26)(H,23,24,27)