N'-(4-azanyl-3-nitro-phenyl)carbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide

Systemtic Name: N'-(4-azanyl-3-nitro-phenyl)carbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide Openeye Name: N'-(4-amino-3-nitro-benzoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide CAS Name: N'-[(4-amino-3-nitrophenyl)-oxomethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide IUPAC Name: N'-(4-amino-3-nitrobenzoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide Traditional Name: N'-(4-amino-3-nitro-benzoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbohydrazide Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)NNC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)NNC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4S/c18-12-7-6-11(8-13(12)21(24)25)16(22)19-20-17(23)15-9-10-4-2-1-3-5-14(10)26-15/h6-9H,1-5,18H2,(H,19,22)(H,20,23)