methyl (E)-4-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: methyl (E)-4-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: methyl (E)-4-[(5-isobutyl-1,3,4-thiadiazol-2-yl)amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxo-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxobut-2-enoate Traditional Name: (E)-4-[(5-isobutyl-1,3,4-thiadiazol-2-yl)amino]-4-keto-but-2-enoic acid methyl ester Formula: C11H15N3O3S MolecularWeight: 269.3201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)NC(=O)C=CC(=O)OC

Isomeric SMILES

CC(C)CC1=NN=C(S1)NC(=O)/C=C/C(=O)OC

InChI

InChI=1S/C11H15N3O3S/c1-7(2)6-9-13-14-11(18-9)12-8(15)4-5-10(16)17-3/h4-5,7H,6H2,1-3H3,(H,12,14,15)/b5-4+