8-chloranyl-2-(1,3-diazinan-1-ylmethyl)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 8-chloranyl-2-(1,3-diazinan-1-ylmethyl)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 8-chloro-2-(hexahydropyrimidin-1-ylmethyl)-1H-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 8-chloro-2-(1,3-diazinan-1-ylmethyl)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 8-chloro-2-(1,3-diazinan-1-ylmethyl)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 8-chloro-2-(hexahydropyrimidin-1-ylmethyl)-1H-benzothiopheno[3,2-d]pyrimidin-4-one Formula: C15H15ClN4OS MolecularWeight: 334.8238

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCN(C1)CC2=NC(=O)C3=C(N2)C4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

C1CNCN(C1)CC2=NC(=O)C3=C(N2)C4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C15H15ClN4OS/c16-9-2-3-11-10(6-9)13-14(22-11)15(21)19-12(18-13)7-20-5-1-4-17-8-20/h2-3,6,17H,1,4-5,7-8H2,(H,18,19,21)