2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]sulfanyl]-6-ethoxy-1,3-benzothiazole

Systemtic Name: 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]sulfanyl]-6-ethoxy-1,3-benzothiazole Openeye Name: 2-[[4,6-bis(1-piperidyl)-1,3,5-triazin-2-yl]sulfanyl]-6-ethoxy-1,3-benzothiazole CAS Name: 2-[[4,6-bis(1-piperidinyl)-1,3,5-triazin-2-yl]thio]-6-ethoxy-1,3-benzothiazole IUPAC Name: 2-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]sulfanyl]-6-ethoxy-1,3-benzothiazole Traditional Name: 2-[(4,6-dipiperidino-s-triazin-2-yl)thio]-6-ethoxy-1,3-benzothiazole Formula: C22H28N6OS2 MolecularWeight: 456.62732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SC3=NC(=NC(=N3)N4CCCCC4)N5CCCCC5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SC3=NC(=NC(=N3)N4CCCCC4)N5CCCCC5

InChI

InChI=1S/C22H28N6OS2/c1-2-29-16-9-10-17-18(15-16)30-22(23-17)31-21-25-19(27-11-5-3-6-12-27)24-20(26-21)28-13-7-4-8-14-28/h9-10,15H,2-8,11-14H2,1H3