2-[(2-azanyl-6-bromanyl-phenyl)methyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[(2-azanyl-6-bromanyl-phenyl)methyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[(2-amino-6-bromo-phenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[(2-amino-6-bromophenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[(2-amino-6-bromophenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-(2-amino-6-bromo-benzyl)-1,1-diketo-1,2-benzothiazol-3-one Formula: C14H11BrN2O3S MolecularWeight: 367.21774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CC3=C(C=CC=C3Br)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CC3=C(C=CC=C3Br)N

InChI

InChI=1S/C14H11BrN2O3S/c15-11-5-3-6-12(16)10(11)8-17-14(18)9-4-1-2-7-13(9)21(17,19)20/h1-7H,8,16H2