(3R)-3-(1,3-benzothiazol-2-yl)-N-(3-methoxyphenyl)piperidine-1-carbothioamide

Systemtic Name: (3R)-3-(1,3-benzothiazol-2-yl)-N-(3-methoxyphenyl)piperidine-1-carbothioamide Openeye Name: (3R)-3-(1,3-benzothiazol-2-yl)-N-(3-methoxyphenyl)piperidine-1-carbothioamide CAS Name: (3R)-3-(1,3-benzothiazol-2-yl)-N-(3-methoxyphenyl)-1-piperidinecarbothioamide IUPAC Name: (3R)-3-(1,3-benzothiazol-2-yl)-N-(3-methoxyphenyl)piperidine-1-carbothioamide Traditional Name: (3R)-3-(1,3-benzothiazol-2-yl)-N-(3-methoxyphenyl)piperidine-1-carbothioamide Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCC[C@H](C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H21N3OS2/c1-24-16-8-4-7-15(12-16)21-20(25)23-11-5-6-14(13-23)19-22-17-9-2-3-10-18(17)26-19/h2-4,7-10,12,14H,5-6,11,13H2,1H3,(H,21,25)/t14-/m1/s1