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

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-4-(cyclopropylamino)-N-methyl-3-nitro-benzamide Openeye Name: N-[(5-bromo-2-thienyl)methyl]-4-(cyclopropylamino)-N-methyl-3-nitro-benzamide CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-4-(cyclopropylamino)-N-methyl-3-nitrobenzamide IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-4-(cyclopropylamino)-N-methyl-3-nitrobenzamide Traditional Name: N-[(5-bromo-2-thienyl)methyl]-4-(cyclopropylamino)-N-methyl-3-nitro-benzamide Formula: C16H16BrN3O3S MolecularWeight: 410.28554

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Br)C(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(S1)Br)C(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C16H16BrN3O3S/c1-19(9-12-5-7-15(17)24-12)16(21)10-2-6-13(18-11-3-4-11)14(8-10)20(22)23/h2,5-8,11,18H,3-4,9H2,1H3