methyl 4-[[4-(3-methoxyphenyl)piperazin-1-yl]carbothioylamino]butanoate

Systemtic Name: methyl 4-[[4-(3-methoxyphenyl)piperazin-1-yl]carbothioylamino]butanoate Openeye Name: methyl 4-[[4-(3-methoxyphenyl)piperazine-1-carbothioyl]amino]butanoate CAS Name: 4-[[[4-(3-methoxyphenyl)-1-piperazinyl]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[4-(3-methoxyphenyl)piperazine-1-carbothioyl]amino]butanoate Traditional Name: 4-[[4-(3-methoxyphenyl)piperazine-1-carbothioyl]amino]butyric acid methyl ester Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=S)NCCCC(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=S)NCCCC(=O)OC

InChI

InChI=1S/C17H25N3O3S/c1-22-15-6-3-5-14(13-15)19-9-11-20(12-10-19)17(24)18-8-4-7-16(21)23-2/h3,5-6,13H,4,7-12H2,1-2H3,(H,18,24)