5-[methyl-(phenylmethyl)amino]-4-nitro-thiophene-2-carbonitrile

Systemtic Name: 5-[methyl-(phenylmethyl)amino]-4-nitro-thiophene-2-carbonitrile Openeye Name: 5-[benzyl(methyl)amino]-4-nitro-thiophene-2-carbonitrile CAS Name: 5-[methyl-(phenylmethyl)amino]-4-nitro-2-thiophenecarbonitrile IUPAC Name: 5-[benzyl(methyl)amino]-4-nitrothiophene-2-carbonitrile Traditional Name: 5-[benzyl(methyl)amino]-4-nitro-thiophene-2-carbonitrile Formula: C13H11N3O2S MolecularWeight: 273.31034

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=C(C=C(S2)C#N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=C(C=C(S2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O2S/c1-15(9-10-5-3-2-4-6-10)13-12(16(17)18)7-11(8-14)19-13/h2-7H,9H2,1H3