methyl 5-tert-butyl-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-tert-butyl-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-tert-butyl-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate CAS Name: 5-tert-butyl-3-[[oxo-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]methyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylate Traditional Name: 5-tert-butyl-3-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C19H20N4O3S2 MolecularWeight: 416.5171

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S1)C(=O)OC)NC(=O)NC2=NN=C(S2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC(=C(S1)C(=O)OC)NC(=O)NC2=NN=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C19H20N4O3S2/c1-19(2,3)13-10-12(14(27-13)16(24)26-4)20-17(25)21-18-23-22-15(28-18)11-8-6-5-7-9-11/h5-10H,1-4H3,(H2,20,21,23,25)