ethyl (E)-3-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-cyano-acrylic acid ethyl ester Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NN=C(S1)C23CC4CC(C2)CC(C4)C3)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=NN=C(S1)C23CC4CC(C2)CC(C4)C3)/C#N

InChI

InChI=1S/C18H22N4O2S/c1-2-24-15(23)14(9-19)10-20-17-22-21-16(25-17)18-6-11-3-12(7-18)5-13(4-11)8-18/h10-13H,2-8H2,1H3,(H,20,22)/b14-10+