methyl 4-[2,6-bis(chloranyl)phenyl]-6-[2-[4-[[1-(ethylaminomethyl)cyclobutyl]methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-1-methyl-2-[2-(1,3-thiazol-2-yl)ethyl]-4H-pyridine-3-carboxylate

Systemtic Name: methyl 4-[2,6-bis(chloranyl)phenyl]-6-[2-[4-[[1-(ethylaminomethyl)cyclobutyl]methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-1-methyl-2-[2-(1,3-thiazol-2-yl)ethyl]-4H-pyridine-3-carboxylate Openeye Name: methyl 4-(2,6-dichlorophenyl)-6-[2-[4-[[1-(ethylaminomethyl)cyclobutyl]methyl]piperazin-1-yl]-2-oxo-ethyl]-1-methyl-2-(2-thiazol-2-ylethyl)-4H-pyridine-3-carboxylate CAS Name: 4-(2,6-dichlorophenyl)-6-[2-[4-[[1-(ethylaminomethyl)cyclobutyl]methyl]-1-piperazinyl]-2-oxoethyl]-1-methyl-2-[2-(2-thiazolyl)ethyl]-4H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(2,6-dichlorophenyl)-6-[2-[4-[[1-(ethylaminomethyl)cyclobutyl]methyl]piperazin-1-yl]-2-oxoethyl]-1-methyl-2-[2-(1,3-thiazol-2-yl)ethyl]-4H-pyridine-3-carboxylate Traditional Name: 4-(2,6-dichlorophenyl)-6-[2-[4-[[1-(ethylaminomethyl)cyclobutyl]methyl]piperazino]-2-keto-ethyl]-1-methyl-2-(2-thiazol-2-ylethyl)-4H-pyridine-3-carboxylic acid methyl ester Formula: C33H43Cl2N5O3S MolecularWeight: 660.69722

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1(CCC1)CN2CCN(CC2)C(=O)CC3=CC(C(=C(N3C)CCC4=NC=CS4)C(=O)OC)C5=C(C=CC=C5Cl)Cl

Isomeric SMILES

CCNCC1(CCC1)CN2CCN(CC2)C(=O)CC3=CC(C(=C(N3C)CCC4=NC=CS4)C(=O)OC)C5=C(C=CC=C5Cl)Cl

InChI

InChI=1S/C33H43Cl2N5O3S/c1-4-36-21-33(11-6-12-33)22-39-14-16-40(17-15-39)29(41)20-23-19-24(30-25(34)7-5-8-26(30)35)31(32(42)43-3)27(38(23)2)9-10-28-37-13-18-44-28/h5,7-8,13,18-19,24,36H,4,6,9-12,14-17,20-22H2,1-3H3