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

Systemtic Name: 3-methyl-7-[(4-nitrophenyl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Openeye Name: 3-methyl-7-[(4-nitrophenyl)sulfanylmethyl]thiazolo[3,2-a]pyrimidin-5-one CAS Name: 3-methyl-7-[[(4-nitrophenyl)thio]methyl]-5-thiazolo[3,2-a]pyrimidinone IUPAC Name: 3-methyl-7-[(4-nitrophenyl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Traditional Name: 3-methyl-7-[[(4-nitrophenyl)thio]methyl]thiazolo[3,2-a]pyrimidin-5-one Formula: C14H11N3O3S2 MolecularWeight: 333.38544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=NC(=CC(=O)N12)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC2=NC(=CC(=O)N12)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O3S2/c1-9-7-22-14-15-10(6-13(18)16(9)14)8-21-12-4-2-11(3-5-12)17(19)20/h2-7H,8H2,1H3