(5-chloranyl-2-methoxy-phenyl)-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2-methoxy-phenyl)-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (5-chloro-2-methoxyphenyl)-[4-(4-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-methoxyphenyl)-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (5-chloro-2-methoxy-phenyl)-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C21H22ClN3O3S/c1-3-28-17-5-4-6-18-19(17)23-21(29-18)25-11-9-24(10-12-25)20(26)15-13-14(22)7-8-16(15)27-2/h4-8,13H,3,9-12H2,1-2H3