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

Systemtic Name: prop-2-enyl N-[3-[1-[[6-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-morpholin-4-yl-pyridin-2-yl]amino]propyl]phenyl]carbamate Openeye Name: allyl N-[3-[1-[[6-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-morpholino-2-pyridyl]amino]propyl]phenyl]carbamate CAS Name: N-[3-[1-[[6-[[(5-ethyl-1,3,4-thiadiazol-2-yl)thio]methyl]-4-(4-morpholinyl)-2-pyridinyl]amino]propyl]phenyl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[3-[1-[[6-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-morpholin-4-ylpyridin-2-yl]amino]propyl]phenyl]carbamate Traditional Name: N-[3-[1-[[6-[[(5-ethyl-1,3,4-thiadiazol-2-yl)thio]methyl]-4-morpholino-2-pyridyl]amino]propyl]phenyl]carbamic acid allyl ester Formula: C27H34N6O3S2 MolecularWeight: 554.72726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34N6O3S2/c1-4-12-36-26(34)29-20-9-7-8-19(15-20)23(5-2)30-24-17-22(33-10-13-35-14-11-33)16-21(28-24)18-37-27-32-31-25(6-3)38-27/h4,7-9,15-17,23H,1,5-6,10-14,18H2,2-3H3,(H,28,30)(H,29,34)