2-[methyl-(phenylmethyl)amino]-5-nitro-thiophene-3-carboxamide

Systemtic Name: 2-[methyl-(phenylmethyl)amino]-5-nitro-thiophene-3-carboxamide Openeye Name: 2-[benzyl(methyl)amino]-5-nitro-thiophene-3-carboxamide CAS Name: 2-[methyl-(phenylmethyl)amino]-5-nitro-3-thiophenecarboxamide IUPAC Name: 2-[benzyl(methyl)amino]-5-nitrothiophene-3-carboxamide Traditional Name: 2-[benzyl(methyl)amino]-5-nitro-thiophene-3-carboxamide Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O3S/c1-15(8-9-5-3-2-4-6-9)13-10(12(14)17)7-11(20-13)16(18)19/h2-7H,8H2,1H3,(H2,14,17)