methyl 3-[[4-[1-(2-methoxyethoxymethyl)imidazol-2-yl]piperidin-1-yl]carbothioylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-[1-(2-methoxyethoxymethyl)imidazol-2-yl]piperidin-1-yl]carbothioylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-[1-(2-methoxyethoxymethyl)imidazol-2-yl]piperidine-1-carbothioyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[4-[1-(2-methoxyethoxymethyl)-2-imidazolyl]-1-piperidinyl]-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-[1-(2-methoxyethoxymethyl)imidazol-2-yl]piperidine-1-carbothioyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[4-[1-(2-methoxyethoxymethyl)imidazol-2-yl]piperidine-1-carbothioyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C19H26N4O4S2 MolecularWeight: 438.56414

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCN1C=CN=C1C2CCN(CC2)C(=S)NC3=C(SC=C3)C(=O)OC

Isomeric SMILES

COCCOCN1C=CN=C1C2CCN(CC2)C(=S)NC3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C19H26N4O4S2/c1-25-10-11-27-13-23-9-6-20-17(23)14-3-7-22(8-4-14)19(28)21-15-5-12-29-16(15)18(24)26-2/h5-6,9,12,14H,3-4,7-8,10-11,13H2,1-2H3,(H,21,28)