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

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbothioyl-4-tert-butyl-benzamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbothioyl]-4-tert-butyl-benzamide CAS Name: N-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-sulfanylidenemethyl]-4-tert-butylbenzamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbothioyl]-4-tert-butylbenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbothioyl]-4-tert-butyl-benzamide Formula: C24H27N3OS2 MolecularWeight: 437.62068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3OS2/c1-24(2,3)18-10-8-16(9-11-18)21(28)26-23(29)27-14-12-17(13-15-27)22-25-19-6-4-5-7-20(19)30-22/h4-11,17H,12-15H2,1-3H3,(H,26,28,29)