2-acetamido-5-bromanyl-N-[2-[[(3R)-1-[(4-methylphenyl)methyl]pyrrolidin-3-yl]amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 2-acetamido-5-bromanyl-N-[2-[[(3R)-1-[(4-methylphenyl)methyl]pyrrolidin-3-yl]amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 2-acetamido-5-bromo-N-[2-oxo-2-[[(3R)-1-(p-tolylmethyl)pyrrolidin-3-yl]amino]ethyl]benzamide CAS Name: 2-acetamido-5-bromo-N-[2-[[(3R)-1-[(4-methylphenyl)methyl]-3-pyrrolidinyl]amino]-2-oxoethyl]benzamide IUPAC Name: 2-acetamido-5-bromo-N-[2-[[(3R)-1-[(4-methylphenyl)methyl]pyrrolidin-3-yl]amino]-2-oxoethyl]benzamide Traditional Name: 2-acetamido-5-bromo-N-[2-keto-2-[[(3R)-1-(4-methylbenzyl)pyrrolidin-3-yl]amino]ethyl]benzamide Formula: C23H27BrN4O3 MolecularWeight: 487.38948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCC(C2)NC(=O)CNC(=O)C3=C(C=CC(=C3)Br)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CC[C@H](C2)NC(=O)CNC(=O)C3=C(C=CC(=C3)Br)NC(=O)C

InChI

InChI=1S/C23H27BrN4O3/c1-15-3-5-17(6-4-15)13-28-10-9-19(14-28)27-22(30)12-25-23(31)20-11-18(24)7-8-21(20)26-16(2)29/h3-8,11,19H,9-10,12-14H2,1-2H3,(H,25,31)(H,26,29)(H,27,30)/t19-/m1/s1