4-[(5-bromanylthiophen-2-yl)methyl-methyl-amino]-3-nitro-benzamide

Systemtic Name: 4-[(5-bromanylthiophen-2-yl)methyl-methyl-amino]-3-nitro-benzamide Openeye Name: 4-[(5-bromo-2-thienyl)methyl-methyl-amino]-3-nitro-benzamide CAS Name: 4-[(5-bromo-2-thiophenyl)methyl-methylamino]-3-nitrobenzamide IUPAC Name: 4-[(5-bromothiophen-2-yl)methyl-methylamino]-3-nitrobenzamide Traditional Name: 4-[(5-bromo-2-thienyl)methyl-methyl-amino]-3-nitro-benzamide Formula: C13H12BrN3O3S MolecularWeight: 370.22168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrN3O3S/c1-16(7-9-3-5-12(14)21-9)10-4-2-8(13(15)18)6-11(10)17(19)20/h2-6H,7H2,1H3,(H2,15,18)