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

Systemtic Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-3-carboxamide Openeye Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-3-carboxamide CAS Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-phenyl-3-pyrazolecarboxamide IUPAC Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-phenylpyrazole-3-carboxamide Traditional Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-3-carboxamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=N2)NC(=O)C3=NN(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1CCC2=C(C1)SC(=N2)NC(=O)C3=NN(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C18H18N4OS/c1-12-7-8-14-16(11-12)24-18(19-14)20-17(23)15-9-10-22(21-15)13-5-3-2-4-6-13/h2-6,9-10,12H,7-8,11H2,1H3,(H,19,20,23)