(3R)-3-(1,3-benzothiazol-2-yl)-N-(4-methoxyphenyl)piperidine-1-carbothioamide

Systemtic Name: (3R)-3-(1,3-benzothiazol-2-yl)-N-(4-methoxyphenyl)piperidine-1-carbothioamide Openeye Name: (3R)-3-(1,3-benzothiazol-2-yl)-N-(4-methoxyphenyl)piperidine-1-carbothioamide CAS Name: (3R)-3-(1,3-benzothiazol-2-yl)-N-(4-methoxyphenyl)-1-piperidinecarbothioamide IUPAC Name: (3R)-3-(1,3-benzothiazol-2-yl)-N-(4-methoxyphenyl)piperidine-1-carbothioamide Traditional Name: (3R)-3-(1,3-benzothiazol-2-yl)-N-(4-methoxyphenyl)piperidine-1-carbothioamide Formula: C20H21N3OS2 MolecularWeight: 383.53024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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