2-azanyl-N-[2-[[(3R)-1-[(4-ethylphenyl)methyl]pyrrolidin-3-yl]amino]-2-oxidanylidene-ethyl]-5-iodanyl-benzamide

Systemtic Name: 2-azanyl-N-[2-[[(3R)-1-[(4-ethylphenyl)methyl]pyrrolidin-3-yl]amino]-2-oxidanylidene-ethyl]-5-iodanyl-benzamide Openeye Name: 2-amino-N-[2-[[(3R)-1-[(4-ethylphenyl)methyl]pyrrolidin-3-yl]amino]-2-oxo-ethyl]-5-iodo-benzamide CAS Name: 2-amino-N-[2-[[(3R)-1-[(4-ethylphenyl)methyl]-3-pyrrolidinyl]amino]-2-oxoethyl]-5-iodobenzamide IUPAC Name: 2-amino-N-[2-[[(3R)-1-[(4-ethylphenyl)methyl]pyrrolidin-3-yl]amino]-2-oxoethyl]-5-iodobenzamide Traditional Name: 2-amino-N-[2-[[(3R)-1-(4-ethylbenzyl)pyrrolidin-3-yl]amino]-2-keto-ethyl]-5-iodo-benzamide Formula: C22H27IN4O2 MolecularWeight: 506.37985

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCC(C2)NC(=O)CNC(=O)C3=C(C=CC(=C3)I)N

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CC[C@H](C2)NC(=O)CNC(=O)C3=C(C=CC(=C3)I)N

InChI

InChI=1S/C22H27IN4O2/c1-2-15-3-5-16(6-4-15)13-27-10-9-18(14-27)26-21(28)12-25-22(29)19-11-17(23)7-8-20(19)24/h3-8,11,18H,2,9-10,12-14,24H2,1H3,(H,25,29)(H,26,28)/t18-/m1/s1