dimethyl 3-methyl-5-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]carbothioylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]carbothioylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[4-(1-naphthylmethyl)piperazine-1-carbothioyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[4-(1-naphthalenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[4-(naphthalen-1-ylmethyl)piperazine-1-carbothioyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[4-(1-naphthylmethyl)piperazine-1-carbothioyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C25H27N3O4S2 MolecularWeight: 497.62958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCN(CC2)CC3=CC=CC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCN(CC2)CC3=CC=CC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C25H27N3O4S2/c1-16-20(23(29)31-2)22(34-21(16)24(30)32-3)26-25(33)28-13-11-27(12-14-28)15-18-9-6-8-17-7-4-5-10-19(17)18/h4-10H,11-15H2,1-3H3,(H,26,33)