(4-tert-butylphenyl)-[4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[4-(4-chloro-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (4-tert-butylphenyl)-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C22H24ClN3OS MolecularWeight: 413.96346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=CC=C4Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=CC=C4Cl

InChI

InChI=1S/C22H24ClN3OS/c1-22(2,3)16-9-7-15(8-10-16)20(27)25-11-13-26(14-12-25)21-24-19-17(23)5-4-6-18(19)28-21/h4-10H,11-14H2,1-3H3