5-(4-nitrophenyl)-3-[(4-propan-2-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-nitrophenyl)-3-[(4-propan-2-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(4-isopropylphenyl)methyl]-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-nitrophenyl)-3-[(4-propan-2-ylphenyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-nitrophenyl)-3-[(4-propan-2-ylphenyl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-isopropylbenzyl)-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O3S/c1-14(2)16-5-3-15(4-6-16)11-24-13-23-21-20(22(24)26)19(12-29-21)17-7-9-18(10-8-17)25(27)28/h3-10,12-14H,11H2,1-2H3