1,3-bis(1,3-benzothiazol-2-ylsulfanyl)propan-2-one

Systemtic Name: 1,3-bis(1,3-benzothiazol-2-ylsulfanyl)propan-2-one Openeye Name: 1,3-bis(1,3-benzothiazol-2-ylsulfanyl)propan-2-one CAS Name: 1,3-bis(1,3-benzothiazol-2-ylthio)-2-propanone IUPAC Name: 1,3-bis(1,3-benzothiazol-2-ylsulfanyl)propan-2-one Traditional Name: 1,3-bis(1,3-benzothiazol-2-ylthio)acetone Formula: C17H12N2OS4 MolecularWeight: 388.54998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H12N2OS4/c20-11(9-21-16-18-12-5-1-3-7-14(12)23-16)10-22-17-19-13-6-2-4-8-15(13)24-17/h1-8H,9-10H2