6-methyl-1-(4-nitrophenyl)carbonyl-3-propan-2-yl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 6-methyl-1-(4-nitrophenyl)carbonyl-3-propan-2-yl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 3-isopropyl-6-methyl-1-(4-nitrobenzoyl)-2-thioxo-pyrimidin-4-one CAS Name: 6-methyl-1-[(4-nitrophenyl)-oxomethyl]-3-propan-2-yl-2-sulfanylidene-4-pyrimidinone IUPAC Name: 6-methyl-1-(4-nitrobenzoyl)-3-propan-2-yl-2-sulfanylidenepyrimidin-4-one Traditional Name: 3-isopropyl-6-methyl-1-(4-nitrobenzoyl)-2-thioxo-pyrimidin-4-one Formula: C15H15N3O4S MolecularWeight: 333.3623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=S)N1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

Isomeric SMILES

CC1=CC(=O)N(C(=S)N1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C15H15N3O4S/c1-9(2)16-13(19)8-10(3)17(15(16)23)14(20)11-4-6-12(7-5-11)18(21)22/h4-9H,1-3H3