2-[1-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[1-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[1-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[1-[(5-chloro-1,3-benzothiazol-2-yl)thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[1-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[1-[(5-chloro-1,3-benzothiazol-2-yl)thio]ethyl]-1H-quinazolin-4-one Formula: C17H12ClN3OS2 MolecularWeight: 373.87968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)SC3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)SC3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C17H12ClN3OS2/c1-9(15-19-12-5-3-2-4-11(12)16(22)21-15)23-17-20-13-8-10(18)6-7-14(13)24-17/h2-9H,1H3,(H,19,21,22)