3-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 3-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Openeye Name: 3-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxo-propyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione CAS Name: 3-[3-[4-(4-nitrophenyl)-1-piperazinyl]-3-oxopropyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione IUPAC Name: 3-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Traditional Name: 3-[3-keto-3-[4-(4-nitrophenyl)piperazino]propyl]-1H-thieno[3,2-d]pyrimidine-2,4-quinone Formula: C19H19N5O5S MolecularWeight: 429.44966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCN3C(=O)C4=C(C=CS4)NC3=O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCN3C(=O)C4=C(C=CS4)NC3=O

InChI

InChI=1S/C19H19N5O5S/c25-16(5-7-23-18(26)17-15(6-12-30-17)20-19(23)27)22-10-8-21(9-11-22)13-1-3-14(4-2-13)24(28)29/h1-4,6,12H,5,7-11H2,(H,20,27)