4-chloranyl-N-[2-[[4-[2-[2-cyanoethyl(pyridin-3-ylmethyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]-N-(2-methoxyethyl)benzamide

Systemtic Name: 4-chloranyl-N-[2-[[4-[2-[2-cyanoethyl(pyridin-3-ylmethyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]-N-(2-methoxyethyl)benzamide Openeye Name: 4-chloro-N-[2-[[4-[2-[2-cyanoethyl(3-pyridylmethyl)amino]-2-oxo-ethyl]thiazol-2-yl]amino]-2-oxo-ethyl]-N-(2-methoxyethyl)benzamide CAS Name: 4-chloro-N-[2-[[4-[2-[2-cyanoethyl(3-pyridinylmethyl)amino]-2-oxoethyl]-2-thiazolyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)benzamide IUPAC Name: 4-chloro-N-[2-[[4-[2-[2-cyanoethyl(pyridin-3-ylmethyl)amino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]-N-(2-methoxyethyl)benzamide Traditional Name: 4-chloro-N-[2-[[4-[2-[2-cyanoethyl(3-pyridylmethyl)amino]-2-keto-ethyl]thiazol-2-yl]amino]-2-keto-ethyl]-N-(2-methoxyethyl)benzamide Formula: C26H27ClN6O4S MolecularWeight: 555.04838

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC(=O)NC1=NC(=CS1)CC(=O)N(CCC#N)CC2=CN=CC=C2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COCCN(CC(=O)NC1=NC(=CS1)CC(=O)N(CCC#N)CC2=CN=CC=C2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H27ClN6O4S/c1-37-13-12-33(25(36)20-5-7-21(27)8-6-20)17-23(34)31-26-30-22(18-38-26)14-24(35)32(11-3-9-28)16-19-4-2-10-29-15-19/h2,4-8,10,15,18H,3,11-14,16-17H2,1H3,(H,30,31,34)