(2R)-2-(aminomethyl)-3-[6-[(3R)-3-[2,6-bis(chloranyl)-4-methyl-phenoxy]pyrrolidin-1-yl]pyridin-3-yl]-N-[[5-chloranyl-2-(3-methoxypropyl)pyridin-4-yl]methyl]-N-cyclopropyl-propanamide

Systemtic Name: (2R)-2-(aminomethyl)-3-[6-[(3R)-3-[2,6-bis(chloranyl)-4-methyl-phenoxy]pyrrolidin-1-yl]pyridin-3-yl]-N-[[5-chloranyl-2-(3-methoxypropyl)pyridin-4-yl]methyl]-N-cyclopropyl-propanamide Openeye Name: (2R)-2-(aminomethyl)-N-[[5-chloro-2-(3-methoxypropyl)-4-pyridyl]methyl]-N-cyclopropyl-3-[6-[(3R)-3-(2,6-dichloro-4-methyl-phenoxy)pyrrolidin-1-yl]-3-pyridyl]propanamide CAS Name: (2R)-2-(aminomethyl)-N-[[5-chloro-2-(3-methoxypropyl)-4-pyridinyl]methyl]-N-cyclopropyl-3-[6-[(3R)-3-(2,6-dichloro-4-methylphenoxy)-1-pyrrolidinyl]-3-pyridinyl]propanamide IUPAC Name: (2R)-2-(aminomethyl)-N-[[5-chloro-2-(3-methoxypropyl)pyridin-4-yl]methyl]-N-cyclopropyl-3-[6-[(3R)-3-(2,6-dichloro-4-methylphenoxy)pyrrolidin-1-yl]pyridin-3-yl]propanamide Traditional Name: (2R)-2-(aminomethyl)-N-[[5-chloro-2-(3-methoxypropyl)-4-pyridyl]methyl]-N-cyclopropyl-3-[6-[(3R)-3-(2,6-dichloro-4-methyl-phenoxy)pyrrolidino]-3-pyridyl]propionamide Formula: C33H40Cl3N5O3 MolecularWeight: 661.0614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)OC2CCN(C2)C3=NC=C(C=C3)CC(CN)C(=O)N(CC4=CC(=NC=C4Cl)CCCOC)C5CC5)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)O[C@@H]2CCN(C2)C3=NC=C(C=C3)C[C@H](CN)C(=O)N(CC4=CC(=NC=C4Cl)CCCOC)C5CC5)Cl

InChI

InChI=1S/C33H40Cl3N5O3/c1-21-12-28(34)32(29(35)13-21)44-27-9-10-40(20-27)31-8-5-22(17-39-31)14-23(16-37)33(42)41(26-6-7-26)19-24-15-25(4-3-11-43-2)38-18-30(24)36/h5,8,12-13,15,17-18,23,26-27H,3-4,6-7,9-11,14,16,19-20,37H2,1-2H3/t23-,27-/m1/s1