3-[(4-bromophenyl)diazenyl]-2,6-dimethyl-pyrimido[2,1-b][1,3]benzothiazol-4-one

Systemtic Name: 3-[(4-bromophenyl)diazenyl]-2,6-dimethyl-pyrimido[2,1-b][1,3]benzothiazol-4-one Openeye Name: 3-(4-bromophenyl)azo-2,6-dimethyl-pyrimido[2,1-b][1,3]benzothiazol-4-one CAS Name: 3-(4-bromophenyl)azo-2,6-dimethyl-4-pyrimido[2,1-b][1,3]benzothiazolone IUPAC Name: 3-[(4-bromophenyl)diazenyl]-2,6-dimethylpyrimido[2,1-b][1,3]benzothiazol-4-one Traditional Name: 3-(4-bromophenyl)azo-2,6-dimethyl-pyrimido[2,1-b][1,3]benzothiazol-4-one Formula: C18H13BrN4OS MolecularWeight: 413.29102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC3=NC(=C(C(=O)N23)N=NC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC3=NC(=C(C(=O)N23)N=NC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C18H13BrN4OS/c1-10-4-3-5-14-16(10)23-17(24)15(11(2)20-18(23)25-14)22-21-13-8-6-12(19)7-9-13/h3-9H,1-2H3