N-(4-bromanyl-2-methyl-phenyl)-2-[2-[methyl(thiophen-3-ylmethyl)amino]ethanoylamino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-[methyl(thiophen-3-ylmethyl)amino]ethanoylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[methyl(3-thienylmethyl)amino]acetyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[2-[methyl(3-thiophenylmethyl)amino]-1-oxoethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-[methyl(thiophen-3-ylmethyl)amino]acetyl]amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-[methyl(3-thenyl)amino]acetyl]amino]acetamide Formula: C17H20BrN3O2S MolecularWeight: 410.3286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CN(C)CC2=CSC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CN(C)CC2=CSC=C2

InChI

InChI=1S/C17H20BrN3O2S/c1-12-7-14(18)3-4-15(12)20-16(22)8-19-17(23)10-21(2)9-13-5-6-24-11-13/h3-7,11H,8-10H2,1-2H3,(H,19,23)(H,20,22)