7-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 7-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanylmethyl]thiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-[[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]methyl]-5-thiazolo[3,2-a]pyrimidinone IUPAC Name: 7-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-[[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]methyl]thiazolo[3,2-a]pyrimidin-5-one Formula: C21H23N5O3S3 MolecularWeight: 489.63402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC4=CC(=O)N5C=CSC5=N4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SCC4=CC(=O)N5C=CSC5=N4

InChI

InChI=1S/C21H23N5O3S3/c1-2-25-18-7-6-16(32(28,29)24-8-4-3-5-9-24)13-17(18)23-21(25)31-14-15-12-19(27)26-10-11-30-20(26)22-15/h6-7,10-13H,2-5,8-9,14H2,1H3