1-[5-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)-1,2,4-triazol-1-yl]-6,7,8,9-tetrahydro-[1]benzothiolo[2,3-d]pyridazine

Systemtic Name: 1-[5-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)-1,2,4-triazol-1-yl]-6,7,8,9-tetrahydro-[1]benzothiolo[2,3-d]pyridazine Openeye Name: 1-[5-(5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-ylsulfanyl)-1,2,4-triazol-1-yl]-6,7,8,9-tetrahydrobenzothiopheno[2,3-d]pyridazine CAS Name: 1-[5-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylthio)-1,2,4-triazol-1-yl]-6,7,8,9-tetrahydro-[1]benzothiolo[2,3-d]pyridazine IUPAC Name: 1-[5-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)-1,2,4-triazol-1-yl]-6,7,8,9-tetrahydro-[1]benzothiolo[2,3-d]pyridazine Traditional Name: 1-[5-(5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-ylthio)-1,2,4-triazol-1-yl]-6,7,8,9-tetrahydrobenzothiopheno[2,3-d]pyridazine Formula: C22H19N7S3 MolecularWeight: 477.62816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(N=NC=C3S2)N4C(=NC=N4)SC5=NC=NC6=C5C7=C(S6)CCCC7

Isomeric SMILES

C1CCC2=C(C1)C3=C(N=NC=C3S2)N4C(=NC=N4)SC5=NC=NC6=C5C7=C(S6)CCCC7

InChI

InChI=1S/C22H19N7S3/c1-3-7-14-12(5-1)17-16(30-14)9-26-28-19(17)29-22(25-11-27-29)32-21-18-13-6-2-4-8-15(13)31-20(18)23-10-24-21/h9-11H,1-8H2