[4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-ethylsulfanylphenyl)methanone

Systemtic Name: [4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-ethylsulfanylphenyl)methanone Openeye Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-ethylsulfanylphenyl)methanone CAS Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-[2-(ethylthio)phenyl]methanone IUPAC Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-ethylsulfanylphenyl)methanone Traditional Name: [4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazino]-[2-(ethylthio)phenyl]methanone Formula: C21H22ClN3OS2 MolecularWeight: 432.00188

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC4=C(C=CC(=C4S3)Cl)C

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC4=C(C=CC(=C4S3)Cl)C

InChI

InChI=1S/C21H22ClN3OS2/c1-3-27-17-7-5-4-6-15(17)20(26)24-10-12-25(13-11-24)21-23-18-14(2)8-9-16(22)19(18)28-21/h4-9H,3,10-13H2,1-2H3