3-[2-(aziridin-1-yl)-2-oxidanylidene-ethyl]-1-phenethyl-5-phenyl-thieno[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 3-[2-(aziridin-1-yl)-2-oxidanylidene-ethyl]-1-phenethyl-5-phenyl-thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 3-[2-(aziridin-1-yl)-2-oxo-ethyl]-1-phenethyl-5-phenyl-thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 3-[2-(1-aziridinyl)-2-oxoethyl]-1-phenethyl-5-phenylthieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 3-[2-(aziridin-1-yl)-2-oxoethyl]-1-phenethyl-5-phenylthieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 3-(2-ethylenimino-2-keto-ethyl)-1-phenethyl-5-phenyl-thieno[2,3-d]pyrimidine-2,4-quinone Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1C(=O)CN2C(=O)C3=C(N(C2=O)CCC4=CC=CC=C4)SC=C3C5=CC=CC=C5

Isomeric SMILES

C1CN1C(=O)CN2C(=O)C3=C(N(C2=O)CCC4=CC=CC=C4)SC=C3C5=CC=CC=C5

InChI

InChI=1S/C24H21N3O3S/c28-20(25-13-14-25)15-27-22(29)21-19(18-9-5-2-6-10-18)16-31-23(21)26(24(27)30)12-11-17-7-3-1-4-8-17/h1-10,16H,11-15H2