4,7-dimethoxy-2-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole

Systemtic Name: 4,7-dimethoxy-2-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole Openeye Name: 4,7-dimethoxy-2-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole CAS Name: 4,7-dimethoxy-2-[4-(4-methoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-1,3-benzothiazole IUPAC Name: 4,7-dimethoxy-2-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole Traditional Name: 4,7-dimethoxy-2-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazino]-1,3-benzothiazole Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C4=NC5=C(C=CC(=C5S4)OC)OC

Isomeric SMILES

COC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C4=NC5=C(C=CC(=C5S4)OC)OC

InChI

InChI=1S/C21H22N4O3S2/c1-26-13-5-4-6-16-17(13)22-20(29-16)24-9-11-25(12-10-24)21-23-18-14(27-2)7-8-15(28-3)19(18)30-21/h4-8H,9-12H2,1-3H3