methyl 3-(2-dimethylaminoethylcarbamothioylamino)-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-(2-dimethylaminoethylcarbamothioylamino)-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-(2-dimethylaminoethylcarbamothioylamino)benzothiophene-2-carboxylate CAS Name: 3-[[(2-dimethylaminoethylamino)-sulfanylidenemethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-dimethylaminoethylcarbamothioylamino)-1-benzothiophene-2-carboxylate Traditional Name: 3-(2-dimethylaminoethylthiocarbamoylamino)benzothiophene-2-carboxylic acid methyl ester Formula: C15H19N3O2S2 MolecularWeight: 337.46026

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)NC1=C(SC2=CC=CC=C21)C(=O)OC

Isomeric SMILES

CN(C)CCNC(=S)NC1=C(SC2=CC=CC=C21)C(=O)OC

InChI

InChI=1S/C15H19N3O2S2/c1-18(2)9-8-16-15(21)17-12-10-6-4-5-7-11(10)22-13(12)14(19)20-3/h4-7H,8-9H2,1-3H3,(H2,16,17,21)