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

Systemtic Name: 1-[4-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenoxy-propan-1-one Openeye Name: 1-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenoxy-propan-1-one CAS Name: 1-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-3-phenoxy-1-propanone IUPAC Name: 1-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenoxypropan-1-one Traditional Name: 1-[4-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazino]-3-phenoxy-propan-1-one Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N3CCN(CC3)C(=O)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N3CCN(CC3)C(=O)CCOC4=CC=CC=C4

InChI

InChI=1S/C21H22ClN3O2S/c1-15-7-8-17(22)20-19(15)23-21(28-20)25-12-10-24(11-13-25)18(26)9-14-27-16-5-3-2-4-6-16/h2-8H,9-14H2,1H3