1-[4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-3-phenyl-1-propanone IUPAC Name: 1-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazino]-3-phenyl-propan-1-one Formula: C21H22ClN3OS MolecularWeight: 399.93688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N3CCN(CC3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N3CCN(CC3)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C21H22ClN3OS/c1-15-7-9-17(22)20-19(15)23-21(27-20)25-13-11-24(12-14-25)18(26)10-8-16-5-3-2-4-6-16/h2-7,9H,8,10-14H2,1H3