methyl 4-[[methyl-[(4-piperidin-1-ylphenyl)methyl]carbamothioyl]amino]butanoate

Systemtic Name: methyl 4-[[methyl-[(4-piperidin-1-ylphenyl)methyl]carbamothioyl]amino]butanoate Openeye Name: methyl 4-[[methyl-[[4-(1-piperidyl)phenyl]methyl]carbamothioyl]amino]butanoate CAS Name: 4-[[[methyl-[[4-(1-piperidinyl)phenyl]methyl]amino]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[methyl-[(4-piperidin-1-ylphenyl)methyl]carbamothioyl]amino]butanoate Traditional Name: 4-[[methyl-(4-piperidinobenzyl)thiocarbamoyl]amino]butyric acid methyl ester Formula: C19H29N3O2S MolecularWeight: 363.51746

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCCCC2)C(=S)NCCCC(=O)OC

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCCCC2)C(=S)NCCCC(=O)OC

InChI

InChI=1S/C19H29N3O2S/c1-21(19(25)20-12-6-7-18(23)24-2)15-16-8-10-17(11-9-16)22-13-4-3-5-14-22/h8-11H,3-7,12-15H2,1-2H3,(H,20,25)