3-acetamido-N-methyl-N-[(3-nitrophenyl)methyl]-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-methyl-N-[(3-nitrophenyl)methyl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-methyl-N-[(3-nitrophenyl)methyl]-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-methyl-N-[(3-nitrophenyl)methyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-methyl-N-[(3-nitrophenyl)methyl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-methyl-N-(3-nitrobenzyl)-3-(2-thienyl)propionamide Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O4S/c1-12(21)18-15(16-7-4-8-25-16)10-17(22)19(2)11-13-5-3-6-14(9-13)20(23)24/h3-9,15H,10-11H2,1-2H3,(H,18,21)