4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 4-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-1,3-dimethyl-2,6-dioxo-pyrimidine-5-carbonitrile CAS Name: 4-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-1,3-dimethyl-2,6-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 4-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1,3-dimethyl-2,6-dioxopyrimidine-5-carbonitrile Traditional Name: 4-[4-(coumaran-5-ylmethyl)piperazino]-2,6-diketo-1,3-dimethyl-pyrimidine-5-carbonitrile Formula: C20H23N5O3 MolecularWeight: 381.42832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C20H23N5O3/c1-22-18(16(12-21)19(26)23(2)20(22)27)25-8-6-24(7-9-25)13-14-3-4-17-15(11-14)5-10-28-17/h3-4,11H,5-10,13H2,1-2H3