N-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbothioyl-4-methyl-benzamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbothioyl-4-methyl-benzamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbothioyl]-4-methyl-benzamide CAS Name: N-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbothioyl]-4-methylbenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbothioyl]-4-methyl-benzamide Formula: C21H21N3OS2 MolecularWeight: 395.54094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H21N3OS2/c1-14-6-8-15(9-7-14)19(25)23-21(26)24-12-10-16(11-13-24)20-22-17-4-2-3-5-18(17)27-20/h2-9,16H,10-13H2,1H3,(H,23,25,26)