3-chloranyl-6-nitro-N-(propan-2-ylideneamino)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-nitro-N-(propan-2-ylideneamino)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(isopropylideneamino)-6-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-6-nitro-N-(propan-2-ylideneamino)-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-nitro-N-(propan-2-ylideneamino)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(isopropylideneamino)-6-nitro-benzothiophene-2-carboxamide Formula: C12H10ClN3O3S MolecularWeight: 311.7441

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=C(C2=C(S1)C=C(C=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC(=NNC(=O)C1=C(C2=C(S1)C=C(C=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C12H10ClN3O3S/c1-6(2)14-15-12(17)11-10(13)8-4-3-7(16(18)19)5-9(8)20-11/h3-5H,1-2H3,(H,15,17)