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

Systemtic Name: (2R)-2-(1,3-benzothiazol-2-yl)-N-phenethyl-piperidine-1-carbothioamide Openeye Name: (2R)-2-(1,3-benzothiazol-2-yl)-N-phenethyl-piperidine-1-carbothioamide CAS Name: (2R)-2-(1,3-benzothiazol-2-yl)-N-phenethyl-1-piperidinecarbothioamide IUPAC Name: (2R)-2-(1,3-benzothiazol-2-yl)-N-phenethylpiperidine-1-carbothioamide Traditional Name: (2R)-2-(1,3-benzothiazol-2-yl)-N-phenethyl-piperidine-1-carbothioamide Formula: C21H23N3S2 MolecularWeight: 381.55742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)C(=S)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCN([C@H](C1)C2=NC3=CC=CC=C3S2)C(=S)NCCC4=CC=CC=C4

InChI

InChI=1S/C21H23N3S2/c25-21(22-14-13-16-8-2-1-3-9-16)24-15-7-6-11-18(24)20-23-17-10-4-5-12-19(17)26-20/h1-5,8-10,12,18H,6-7,11,13-15H2,(H,22,25)/t18-/m1/s1