methyl 2-[(5-tert-butyl-2-oxidanyl-phenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(5-tert-butyl-2-oxidanyl-phenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(5-tert-butyl-2-hydroxy-phenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(5-tert-butyl-2-hydroxyanilino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-tert-butyl-2-hydroxyphenyl)carbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(5-tert-butyl-2-hydroxy-phenyl)thiocarbamoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C18H22N2O3S2 MolecularWeight: 378.50888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NC2=C(C=CC(=C2)C(C)(C)C)O)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NC2=C(C=CC(=C2)C(C)(C)C)O)C(=O)OC

InChI

InChI=1S/C18H22N2O3S2/c1-10-8-12(16(22)23-5)15(25-10)20-17(24)19-13-9-11(18(2,3)4)6-7-14(13)21/h6-9,21H,1-5H3,(H2,19,20,24)