N-(6-acetamido-1,3-benzothiazol-2-yl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-1-benzyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-1-benzyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-1-benzyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C24H19N5O2S2 MolecularWeight: 473.56996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C24H19N5O2S2/c1-15(30)25-17-9-10-19-21(12-17)33-24(26-19)27-23(31)18-14-29(13-16-6-3-2-4-7-16)28-22(18)20-8-5-11-32-20/h2-12,14H,13H2,1H3,(H,25,30)(H,26,27,31)