2-[(3,5-dimethylphenyl)methyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[(3,5-dimethylphenyl)methyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[(3,5-dimethylphenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[(3,5-dimethylphenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[(3,5-dimethylphenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-(3,5-dimethylbenzyl)-1,1-diketo-1,2-benzothiazol-3-one Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN2C(=O)C3=CC=CC=C3S2(=O)=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN2C(=O)C3=CC=CC=C3S2(=O)=O)C

InChI

InChI=1S/C16H15NO3S/c1-11-7-12(2)9-13(8-11)10-17-16(18)14-5-3-4-6-15(14)21(17,19)20/h3-9H,10H2,1-2H3