methyl 4-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamoyl]benzoate Openeye Name: methyl 4-[(5-isobutyl-1,3,4-thiadiazol-2-yl)carbamoyl]benzoate CAS Name: 4-[[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]carbamoyl]benzoate Traditional Name: 4-[(5-isobutyl-1,3,4-thiadiazol-2-yl)carbamoyl]benzoic acid methyl ester Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H17N3O3S/c1-9(2)8-12-17-18-15(22-12)16-13(19)10-4-6-11(7-5-10)14(20)21-3/h4-7,9H,8H2,1-3H3,(H,16,18,19)