2-[(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]-5-nitro-benzaldehyde

Systemtic Name: 2-[(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]-5-nitro-benzaldehyde Openeye Name: 2-[(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]-5-nitro-benzaldehyde CAS Name: 2-[(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)thio]-5-nitrobenzaldehyde IUPAC Name: 2-[(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)sulfanyl]-5-nitrobenzaldehyde Traditional Name: 2-[(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)thio]-5-nitro-benzaldehyde Formula: C15H13N3O3S MolecularWeight: 315.34702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1CCC2)SC3=C(C=C(C=C3)[N+](=O)[O-])C=O

Isomeric SMILES

CC1=NC(=NC2=C1CCC2)SC3=C(C=C(C=C3)[N+](=O)[O-])C=O

InChI

InChI=1S/C15H13N3O3S/c1-9-12-3-2-4-13(12)17-15(16-9)22-14-6-5-11(18(20)21)7-10(14)8-19/h5-8H,2-4H2,1H3