7-[(2-azanyl-4-bromanyl-phenyl)sulfanylmethyl]-3-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 7-[(2-azanyl-4-bromanyl-phenyl)sulfanylmethyl]-3-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-[(2-amino-4-bromo-phenyl)sulfanylmethyl]-3-methyl-thiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-[[(2-amino-4-bromophenyl)thio]methyl]-3-methyl-5-thiazolo[3,2-a]pyrimidinone IUPAC Name: 7-[(2-amino-4-bromophenyl)sulfanylmethyl]-3-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-[[(2-amino-4-bromo-phenyl)thio]methyl]-3-methyl-thiazolo[3,2-a]pyrimidin-5-one Formula: C14H12BrN3OS2 MolecularWeight: 382.29858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=NC(=CC(=O)N12)CSC3=C(C=C(C=C3)Br)N

Isomeric SMILES

CC1=CSC2=NC(=CC(=O)N12)CSC3=C(C=C(C=C3)Br)N

InChI

InChI=1S/C14H12BrN3OS2/c1-8-6-21-14-17-10(5-13(19)18(8)14)7-20-12-3-2-9(15)4-11(12)16/h2-6H,7,16H2,1H3