4-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 4-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 4-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1,3-dimethyl-2,6-dioxo-pyrimidine-5-carbonitrile CAS Name: 4-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1,3-dimethyl-2,6-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 4-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1,3-dimethyl-2,6-dioxopyrimidine-5-carbonitrile Traditional Name: 4-[ethyl(piperonyl)amino]-2,6-diketo-1,3-dimethyl-pyrimidine-5-carbonitrile Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C3=C(C(=O)N(C(=O)N3C)C)C#N

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C3=C(C(=O)N(C(=O)N3C)C)C#N

InChI

InChI=1S/C17H18N4O4/c1-4-21(9-11-5-6-13-14(7-11)25-10-24-13)15-12(8-18)16(22)20(3)17(23)19(15)2/h5-7H,4,9-10H2,1-3H3