prop-2-enyl N-[3-[[[6-[(5-ethyl-4-methyl-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-[(5-ethyl-4-methyl-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-[(5-ethyl-4-methyl-thiazol-2-yl)sulfanylmethyl]-4-morpholino-2-pyridyl]amino]methyl]-5-methyl-phenyl]carbamate CAS Name: N-[3-[[[6-[[(5-ethyl-4-methyl-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-[(5-ethyl-4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-4-morpholin-4-ylpyridin-2-yl]amino]methyl]-5-methylphenyl]carbamate Traditional Name: N-[3-[[[6-[[(5-ethyl-4-methyl-thiazol-2-yl)thio]methyl]-4-morpholino-2-pyridyl]amino]methyl]-5-methyl-phenyl]carbamic acid allyl ester Formula: C28H35N5O3S2 MolecularWeight: 553.7392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)SCC2=NC(=CC(=C2)N3CCOCC3)NCC4=CC(=CC(=C4)C)NC(=O)OCC=C)C

Isomeric SMILES

CCC1=C(N=C(S1)SCC2=NC(=CC(=C2)N3CCOCC3)NCC4=CC(=CC(=C4)C)NC(=O)OCC=C)C

InChI

InChI=1S/C28H35N5O3S2/c1-5-9-36-27(34)32-22-13-19(3)12-21(14-22)17-29-26-16-24(33-7-10-35-11-8-33)15-23(31-26)18-37-28-30-20(4)25(6-2)38-28/h5,12-16H,1,6-11,17-18H2,2-4H3,(H,29,31)(H,32,34)