2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]-N-(2-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]-N-(2-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-N-(2-methyl-3-nitro-phenyl)acetamide CAS Name: 2-[(5-bromo-2-thiophenyl)methyl-ethylamino]-N-(2-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-[(5-bromothiophen-2-yl)methyl-ethylamino]-N-(2-methyl-3-nitrophenyl)acetamide Traditional Name: 2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-N-(2-methyl-3-nitro-phenyl)acetamide Formula: C16H18BrN3O3S MolecularWeight: 412.30142

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)CC(=O)NC2=C(C(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)CC(=O)NC2=C(C(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H18BrN3O3S/c1-3-19(9-12-7-8-15(17)24-12)10-16(21)18-13-5-4-6-14(11(13)2)20(22)23/h4-8H,3,9-10H2,1-2H3,(H,18,21)