methyl 4-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]carbothioylamino]butanoate

Systemtic Name: methyl 4-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]carbothioylamino]butanoate Openeye Name: methyl 4-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carbothioyl]amino]butanoate CAS Name: 4-[[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carbothioyl]amino]butanoate Traditional Name: 4-[[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carbothioyl]amino]butyric acid methyl ester Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=S)N1CCC(=CC1)C2=CNC3=CC=CC=C32

Isomeric SMILES

COC(=O)CCCNC(=S)N1CCC(=CC1)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C19H23N3O2S/c1-24-18(23)7-4-10-20-19(25)22-11-8-14(9-12-22)16-13-21-17-6-3-2-5-15(16)17/h2-3,5-6,8,13,21H,4,7,9-12H2,1H3,(H,20,25)