4-[1-propyl-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[1-propyl-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-propyl-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-propyl-2-[(4-thieno[2,3-d]pyrimidinylthio)methyl]-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-propyl-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-propyl-2-[(thieno[2,3-d]pyrimidin-4-ylthio)methyl]benzimidazol-5-yl]sulfonylmorpholine Formula: C21H23N5O3S3 MolecularWeight: 489.63402

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC=NC5=C4C=CS5

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC=NC5=C4C=CS5

InChI

InChI=1S/C21H23N5O3S3/c1-2-6-26-18-4-3-15(32(27,28)25-7-9-29-10-8-25)12-17(18)24-19(26)13-31-21-16-5-11-30-20(16)22-14-23-21/h3-5,11-12,14H,2,6-10,13H2,1H3