ethyl N-[2-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-1,3-benzothiazol-6-yl]carbamate

Systemtic Name: ethyl N-[2-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-1,3-benzothiazol-6-yl]carbamate Openeye Name: ethyl N-[2-[6-(4-methylpiperazin-1-yl)-3-pyridyl]-1,3-benzothiazol-6-yl]carbamate CAS Name: N-[2-[6-(4-methyl-1-piperazinyl)-3-pyridinyl]-1,3-benzothiazol-6-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-1,3-benzothiazol-6-yl]carbamate Traditional Name: N-[2-[6-(4-methylpiperazino)-3-pyridyl]-1,3-benzothiazol-6-yl]carbamic acid ethyl ester Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)N=C(S2)C3=CN=C(C=C3)N4CCN(CC4)C

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)N=C(S2)C3=CN=C(C=C3)N4CCN(CC4)C

InChI

InChI=1S/C20H23N5O2S/c1-3-27-20(26)22-15-5-6-16-17(12-15)28-19(23-16)14-4-7-18(21-13-14)25-10-8-24(2)9-11-25/h4-7,12-13H,3,8-11H2,1-2H3,(H,22,26)