N-[(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(1-ethyl-2,5-dimethyl-3-pyrrolyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(1-ethyl-2,5-dimethylpyrrol-3-yl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=CC(=C1C)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H18N4O3S/c1-4-21-11(2)7-14(12(21)3)10-19-20-18(23)17-9-13-8-15(22(24)25)5-6-16(13)26-17/h5-10H,4H2,1-3H3,(H,20,23)