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

Systemtic Name: 8-chloranyl-2-(3-pyrrolidin-1-ylpropyl)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 8-chloro-2-(3-pyrrolidin-1-ylpropyl)-1H-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 8-chloro-2-[3-(1-pyrrolidinyl)propyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 8-chloro-2-(3-pyrrolidin-1-ylpropyl)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 8-chloro-2-(3-pyrrolidinopropyl)-1H-benzothiopheno[3,2-d]pyrimidin-4-one Formula: C17H18ClN3OS MolecularWeight: 347.86232

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCC2=NC(=O)C3=C(N2)C4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

C1CCN(C1)CCCC2=NC(=O)C3=C(N2)C4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C17H18ClN3OS/c18-11-5-6-13-12(10-11)15-16(23-13)17(22)20-14(19-15)4-3-9-21-7-1-2-8-21/h5-6,10H,1-4,7-9H2,(H,19,20,22)