1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]propan-1-one

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]propan-1-one Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-[(2-methylthiazol-4-yl)methylsulfanyl]propan-1-one CAS Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-[(2-methyl-4-thiazolyl)methylthio]-1-propanone IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]propan-1-one Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)piperidino]-3-[(2-methylthiazol-4-yl)methylthio]propan-1-one Formula: C20H23N3OS3 MolecularWeight: 417.61112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSCCC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NC(=CS1)CSCCC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H23N3OS3/c1-14-21-16(13-26-14)12-25-10-8-19(24)23-9-4-5-15(11-23)20-22-17-6-2-3-7-18(17)27-20/h2-3,6-7,13,15H,4-5,8-12H2,1H3