N-[3-methyl-1-[methyl-[(3-nitrophenyl)methyl]amino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-methyl-1-[methyl-[(3-nitrophenyl)methyl]amino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-methyl-1-[methyl-[(3-nitrophenyl)methyl]carbamoyl]propyl]thiophene-2-carboxamide CAS Name: N-[3-methyl-1-[methyl-[(3-nitrophenyl)methyl]amino]-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-methyl-1-[methyl-[(3-nitrophenyl)methyl]amino]-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-methyl-1-[methyl-(3-nitrobenzyl)carbamoyl]propyl]thiophene-2-carboxamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C)CC1=CC(=CC=C1)[N+](=O)[O-])NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)C(C(=O)N(C)CC1=CC(=CC=C1)[N+](=O)[O-])NC(=O)C2=CC=CS2

InChI

InChI=1S/C18H21N3O4S/c1-12(2)16(19-17(22)15-8-5-9-26-15)18(23)20(3)11-13-6-4-7-14(10-13)21(24)25/h4-10,12,16H,11H2,1-3H3,(H,19,22)