2-[2-[[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[[2-(2-bromoanilino)-2-oxo-ethyl]-methyl-amino]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[[2-(2-bromoanilino)-2-oxoethyl]-methylamino]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[[2-(2-bromoanilino)-2-oxoethyl]-methylamino]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[[2-(2-bromoanilino)-2-keto-ethyl]-methyl-amino]acetyl]amino]thiophene-3-carboxamide Formula: C16H17BrN4O3S MolecularWeight: 425.30018

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1Br)CC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1Br)CC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C16H17BrN4O3S/c1-21(8-13(22)19-12-5-3-2-4-11(12)17)9-14(23)20-16-10(15(18)24)6-7-25-16/h2-7H,8-9H2,1H3,(H2,18,24)(H,19,22)(H,20,23)