3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide

Systemtic Name: 3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide Openeye Name: 3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide CAS Name: 3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide IUPAC Name: 3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide Traditional Name: 3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CC(=NN3)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CC(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C17H16N4OS/c22-16(19-17-18-12-8-4-5-9-15(12)23-17)14-10-13(20-21-14)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,20,21)(H,18,19,22)