N-[(6R)-3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[(6R)-3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[(6R)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[(6R)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[(6R)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[(6R)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide Formula: C15H17N5O4S MolecularWeight: 363.39158

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=C(C=NN3C)[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=C(C=NN3C)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O4S/c1-7-3-4-8-10(5-7)25-15(11(8)13(16)21)18-14(22)12-9(20(23)24)6-17-19(12)2/h6-7H,3-5H2,1-2H3,(H2,16,21)(H,18,22)/t7-/m1/s1