(3S)-3-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)piperidine-1-carbothioamide

Systemtic Name: (3S)-3-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)piperidine-1-carbothioamide Openeye Name: (3S)-3-(1,3-benzothiazol-2-yl)-N-(2-furylmethyl)piperidine-1-carbothioamide CAS Name: (3S)-3-(1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-1-piperidinecarbothioamide IUPAC Name: (3S)-3-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)piperidine-1-carbothioamide Traditional Name: (3S)-3-(1,3-benzothiazol-2-yl)-N-(2-furfuryl)piperidine-1-carbothioamide Formula: C18H19N3OS2 MolecularWeight: 357.49296

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=S)NCC2=CC=CO2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](CN(C1)C(=S)NCC2=CC=CO2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H19N3OS2/c23-18(19-11-14-6-4-10-22-14)21-9-3-5-13(12-21)17-20-15-7-1-2-8-16(15)24-17/h1-2,4,6-8,10,13H,3,5,9,11-12H2,(H,19,23)/t13-/m0/s1