(5S)-5-ethyl-N'-[4-(methylamino)-3-nitro-phenyl]carbonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: (5S)-5-ethyl-N'-[4-(methylamino)-3-nitro-phenyl]carbonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: (5S)-5-ethyl-N'-[4-(methylamino)-3-nitro-benzoyl]-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: (5S)-5-ethyl-N'-[[4-(methylamino)-3-nitrophenyl]-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: (5S)-5-ethyl-N'-[4-(methylamino)-3-nitrobenzoyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: (5S)-5-ethyl-N'-[4-(methylamino)-3-nitro-benzoyl]-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

Isomeric SMILES

CC[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4S/c1-3-11-4-7-16-13(8-11)10-17(28-16)19(25)22-21-18(24)12-5-6-14(20-2)15(9-12)23(26)27/h5-6,9-11,20H,3-4,7-8H2,1-2H3,(H,21,24)(H,22,25)/t11-/m0/s1