3-bromanyl-N-cyclohexyl-N-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-bromanyl-N-cyclohexyl-N-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-3-bromo-N-cyclohexyl-benzamide CAS Name: 3-bromo-N-cyclohexyl-N-[2-[(3-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]benzamide IUPAC Name: N-[2-[benzyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-3-bromo-N-cyclohexylbenzamide Traditional Name: N-[2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-3-bromo-N-cyclohexyl-benzamide Formula: C28H31BrN2O2S MolecularWeight: 539.52694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CC2=CC=CC=C2)C(=O)CN(C3CCCCC3)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=C(SC=C1)CN(CC2=CC=CC=C2)C(=O)CN(C3CCCCC3)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C28H31BrN2O2S/c1-21-15-16-34-26(21)19-30(18-22-9-4-2-5-10-22)27(32)20-31(25-13-6-3-7-14-25)28(33)23-11-8-12-24(29)17-23/h2,4-5,8-12,15-17,25H,3,6-7,13-14,18-20H2,1H3