2-azanyl-5-bromanyl-N-[2-[[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]methylamino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 2-azanyl-5-bromanyl-N-[2-[[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]methylamino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 2-amino-5-bromo-N-[2-[[1-[(4-methylsulfanylphenyl)methyl]-4-piperidyl]methylamino]-2-oxo-ethyl]benzamide CAS Name: 2-amino-5-bromo-N-[2-[[1-[[4-(methylthio)phenyl]methyl]-4-piperidinyl]methylamino]-2-oxoethyl]benzamide IUPAC Name: 2-amino-5-bromo-N-[2-[[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]methylamino]-2-oxoethyl]benzamide Traditional Name: 2-amino-5-bromo-N-[2-keto-2-[[1-[4-(methylthio)benzyl]-4-piperidyl]methylamino]ethyl]benzamide Formula: C23H29BrN4O2S MolecularWeight: 505.47096

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2CCC(CC2)CNC(=O)CNC(=O)C3=C(C=CC(=C3)Br)N

Isomeric SMILES

CSC1=CC=C(C=C1)CN2CCC(CC2)CNC(=O)CNC(=O)C3=C(C=CC(=C3)Br)N

InChI

InChI=1S/C23H29BrN4O2S/c1-31-19-5-2-17(3-6-19)15-28-10-8-16(9-11-28)13-26-22(29)14-27-23(30)20-12-18(24)4-7-21(20)25/h2-7,12,16H,8-11,13-15,25H2,1H3,(H,26,29)(H,27,30)