6-nitro-4-phenyl-1-(2-pyrrolidin-1-ylethyl)thieno[2,3-d]pyrimidin-2-one

Systemtic Name: 6-nitro-4-phenyl-1-(2-pyrrolidin-1-ylethyl)thieno[2,3-d]pyrimidin-2-one Openeye Name: 6-nitro-4-phenyl-1-(2-pyrrolidin-1-ylethyl)thieno[2,3-d]pyrimidin-2-one CAS Name: 6-nitro-4-phenyl-1-[2-(1-pyrrolidinyl)ethyl]-2-thieno[2,3-d]pyrimidinone IUPAC Name: 6-nitro-4-phenyl-1-(2-pyrrolidin-1-ylethyl)thieno[2,3-d]pyrimidin-2-one Traditional Name: 6-nitro-4-phenyl-1-(2-pyrrolidinoethyl)thieno[2,3-d]pyrimidin-2-one Formula: C18H18N4O3S MolecularWeight: 370.42552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN2C3=C(C=C(S3)[N+](=O)[O-])C(=NC2=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)CCN2C3=C(C=C(S3)[N+](=O)[O-])C(=NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C18H18N4O3S/c23-18-19-16(13-6-2-1-3-7-13)14-12-15(22(24)25)26-17(14)21(18)11-10-20-8-4-5-9-20/h1-3,6-7,12H,4-5,8-11H2