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

Systemtic Name: prop-2-enyl N-[3-[[[6-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-morpholin-4-yl-pyridin-2-yl]amino]methyl]phenyl]carbamate Openeye Name: allyl N-[3-[[[6-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-morpholino-2-pyridyl]amino]methyl]phenyl]carbamate CAS Name: N-[3-[[[6-[[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)thio]methyl]-4-(4-morpholinyl)-2-pyridinyl]amino]methyl]phenyl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[3-[[[6-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-morpholin-4-ylpyridin-2-yl]amino]methyl]phenyl]carbamate Traditional Name: N-[3-[[[6-[[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)thio]methyl]-4-morpholino-2-pyridyl]amino]methyl]phenyl]carbamic acid allyl ester Formula: C26H33N7O3S MolecularWeight: 523.65032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C)SCC2=NC(=CC(=C2)N3CCOCC3)NCC4=CC(=CC=C4)NC(=O)OCC=C

Isomeric SMILES

CCC1=NN=C(N1C)SCC2=NC(=CC(=C2)N3CCOCC3)NCC4=CC(=CC=C4)NC(=O)OCC=C

InChI

InChI=1S/C26H33N7O3S/c1-4-11-36-26(34)29-20-8-6-7-19(14-20)17-27-23-16-22(33-9-12-35-13-10-33)15-21(28-23)18-37-25-31-30-24(5-2)32(25)3/h4,6-8,14-16H,1,5,9-13,17-18H2,2-3H3,(H,27,28)(H,29,34)