N-(3-aminocarbonyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-2-methyl-pyrazole-3-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-2-methyl-pyrazole-3-carboxamide Openeye Name: N-(3-carbamoyl-4,5-dihydrobenzo[g]benzothiophen-2-yl)-2-methyl-pyrazole-3-carboxamide CAS Name: N-(3-carbamoyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-(3-carbamoyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)-2-methylpyrazole-3-carboxamide Traditional Name: N-(3-carbamoyl-4,5-dihydrobenzo[g]benzothiophen-2-yl)-2-methyl-pyrazole-3-carboxamide Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)NC2=C(C3=C(S2)C4=CC=CC=C4CC3)C(=O)N

Isomeric SMILES

CN1C(=CC=N1)C(=O)NC2=C(C3=C(S2)C4=CC=CC=C4CC3)C(=O)N

InChI

InChI=1S/C18H16N4O2S/c1-22-13(8-9-20-22)17(24)21-18-14(16(19)23)12-7-6-10-4-2-3-5-11(10)15(12)25-18/h2-5,8-9H,6-7H2,1H3,(H2,19,23)(H,21,24)