methyl 2-(butylcarbamothioylamino)-4-thiophen-2-yl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(butylcarbamothioylamino)-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: methyl 2-(butylcarbamothioylamino)-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-[[butylamino(sulfanylidene)methyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(butylcarbamothioylamino)-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-(butylthiocarbamoylamino)-4-(2-thienyl)thiophene-3-carboxylic acid methyl ester Formula: C15H18N2O2S3 MolecularWeight: 354.51062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=C(C(=CS1)C2=CC=CS2)C(=O)OC

Isomeric SMILES

CCCCNC(=S)NC1=C(C(=CS1)C2=CC=CS2)C(=O)OC

InChI

InChI=1S/C15H18N2O2S3/c1-3-4-7-16-15(20)17-13-12(14(18)19-2)10(9-22-13)11-6-5-8-21-11/h5-6,8-9H,3-4,7H2,1-2H3,(H2,16,17,20)