prop-2-enyl N-[3-[[[6-[(4-ethyl-1,3-thiazol-2-yl)sulfanylmethyl]-4-morpholin-4-yl-pyridin-2-yl]amino]methyl]-5-methyl-phenyl]carbamate

Systemtic Name: prop-2-enyl N-[3-[[[6-[(4-ethyl-1,3-thiazol-2-yl)sulfanylmethyl]-4-morpholin-4-yl-pyridin-2-yl]amino]methyl]-5-methyl-phenyl]carbamate Openeye Name: allyl N-[3-[[[6-[(4-ethylthiazol-2-yl)sulfanylmethyl]-4-morpholino-2-pyridyl]amino]methyl]-5-methyl-phenyl]carbamate CAS Name: N-[3-[[[6-[[(4-ethyl-2-thiazolyl)thio]methyl]-4-(4-morpholinyl)-2-pyridinyl]amino]methyl]-5-methylphenyl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[3-[[[6-[(4-ethyl-1,3-thiazol-2-yl)sulfanylmethyl]-4-morpholin-4-ylpyridin-2-yl]amino]methyl]-5-methylphenyl]carbamate Traditional Name: N-[3-[[[6-[[(4-ethylthiazol-2-yl)thio]methyl]-4-morpholino-2-pyridyl]amino]methyl]-5-methyl-phenyl]carbamic acid allyl ester Formula: C27H33N5O3S2 MolecularWeight: 539.71262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CSC(=N1)SCC2=NC(=CC(=C2)N3CCOCC3)NCC4=CC(=CC(=C4)C)NC(=O)OCC=C

Isomeric SMILES

CCC1=CSC(=N1)SCC2=NC(=CC(=C2)N3CCOCC3)NCC4=CC(=CC(=C4)C)NC(=O)OCC=C

InChI

InChI=1S/C27H33N5O3S2/c1-4-8-35-26(33)30-22-12-19(3)11-20(13-22)16-28-25-15-24(32-6-9-34-10-7-32)14-23(29-25)18-37-27-31-21(5-2)17-36-27/h4,11-15,17H,1,5-10,16,18H2,2-3H3,(H,28,29)(H,30,33)