N'-(2-methyl-3-nitro-phenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: N'-(2-methyl-3-nitro-phenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: N'-(2-methyl-3-nitro-benzoyl)-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: N'-[(2-methyl-3-nitrophenyl)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: N'-(2-methyl-3-nitrobenzoyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: N'-(2-methyl-3-nitro-benzoyl)-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NNC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NNC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C17H17N3O4S/c1-10-12(6-4-7-13(10)20(23)24)16(21)18-19-17(22)15-9-11-5-2-3-8-14(11)25-15/h4,6-7,9H,2-3,5,8H2,1H3,(H,18,21)(H,19,22)