5-chloranyl-2-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-methyl-1,3-benzothiazole

Systemtic Name: 5-chloranyl-2-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-methyl-1,3-benzothiazole Openeye Name: 5-chloro-2-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-methyl-1,3-benzothiazole CAS Name: 5-chloro-2-[4-(6-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-4-methyl-1,3-benzothiazole IUPAC Name: 5-chloro-2-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-methyl-1,3-benzothiazole Traditional Name: 5-chloro-2-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazino]-4-methyl-1,3-benzothiazole Formula: C21H21ClN4OS2 MolecularWeight: 445.00064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C4=NC5=C(S4)C=CC(=C5C)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C4=NC5=C(S4)C=CC(=C5C)Cl

InChI

InChI=1S/C21H21ClN4OS2/c1-3-27-14-4-6-16-18(12-14)29-20(23-16)25-8-10-26(11-9-25)21-24-19-13(2)15(22)5-7-17(19)28-21/h4-7,12H,3,8-11H2,1-2H3