6-(2-bromophenyl)carbonyl-3-(phenylmethyl)-1,3-benzothiazol-2-one

Systemtic Name: 6-(2-bromophenyl)carbonyl-3-(phenylmethyl)-1,3-benzothiazol-2-one Openeye Name: 3-benzyl-6-(2-bromobenzoyl)-1,3-benzothiazol-2-one CAS Name: 6-[(2-bromophenyl)-oxomethyl]-3-(phenylmethyl)-1,3-benzothiazol-2-one IUPAC Name: 3-benzyl-6-(2-bromobenzoyl)-1,3-benzothiazol-2-one Traditional Name: 3-benzyl-6-(2-bromobenzoyl)-1,3-benzothiazol-2-one Formula: C21H14BrNO2S MolecularWeight: 424.31036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4Br)SC2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4Br)SC2=O

InChI

InChI=1S/C21H14BrNO2S/c22-17-9-5-4-8-16(17)20(24)15-10-11-18-19(12-15)26-21(25)23(18)13-14-6-2-1-3-7-14/h1-12H,13H2