3-azanyl-N-[2,5-bis(oxidanylidene)-4-phenyl-piperazin-1-yl]-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-[2,5-bis(oxidanylidene)-4-phenyl-piperazin-1-yl]-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(2,5-dioxo-4-phenyl-piperazin-1-yl)-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-(2,5-dioxo-4-phenyl-1-piperazinyl)-4,6-dimethyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(2,5-dioxo-4-phenylpiperazin-1-yl)-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-(2,5-diketo-4-phenyl-piperazino)-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)NN3CC(=O)N(CC3=O)C4=CC=CC=C4)N)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)NN3CC(=O)N(CC3=O)C4=CC=CC=C4)N)C

InChI

InChI=1S/C20H19N5O3S/c1-11-8-12(2)22-20-16(11)17(21)18(29-20)19(28)23-25-10-14(26)24(9-15(25)27)13-6-4-3-5-7-13/h3-8H,9-10,21H2,1-2H3,(H,23,28)