methyl 4,5-dimethyl-2-[(4-propylpiperazin-1-yl)carbothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[(4-propylpiperazin-1-yl)carbothioylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[(4-propylpiperazine-1-carbothioyl)amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[(4-propyl-1-piperazinyl)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[(4-propylpiperazine-1-carbothioyl)amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[(4-propylpiperazine-1-carbothioyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C16H25N3O2S2 MolecularWeight: 355.5186

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=S)NC2=C(C(=C(S2)C)C)C(=O)OC

Isomeric SMILES

CCCN1CCN(CC1)C(=S)NC2=C(C(=C(S2)C)C)C(=O)OC

InChI

InChI=1S/C16H25N3O2S2/c1-5-6-18-7-9-19(10-8-18)16(22)17-14-13(15(20)21-4)11(2)12(3)23-14/h5-10H2,1-4H3,(H,17,22)