3-(1-methyl-7-oxidanylidene-3-propyl-2,4,5,6-tetrahydropyrrolo[3,4-d]pyrimidin-5-yl)-4-propoxy-benzenecarbonitrile

Systemtic Name: 3-(1-methyl-7-oxidanylidene-3-propyl-2,4,5,6-tetrahydropyrrolo[3,4-d]pyrimidin-5-yl)-4-propoxy-benzenecarbonitrile Openeye Name: 3-(1-methyl-7-oxo-3-propyl-2,4,5,6-tetrahydropyrrolo[3,4-d]pyrimidin-5-yl)-4-propoxy-benzonitrile CAS Name: 3-(1-methyl-7-oxo-3-propyl-2,4,5,6-tetrahydropyrrolo[3,4-d]pyrimidin-5-yl)-4-propoxybenzonitrile IUPAC Name: 3-(1-methyl-7-oxo-3-propyl-2,4,5,6-tetrahydropyrrolo[3,4-d]pyrimidin-5-yl)-4-propoxybenzonitrile Traditional Name: 3-(7-keto-1-methyl-3-propyl-2,4,5,6-tetrahydropyrrolo[3,4-d]pyrimidin-5-yl)-4-propoxy-benzonitrile Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC2=C(C(=O)NC2C3=C(C=CC(=C3)C#N)OCCC)N(C1)C

Isomeric SMILES

CCCN1CC2=C(C(=O)NC2C3=C(C=CC(=C3)C#N)OCCC)N(C1)C

InChI

InChI=1S/C20H26N4O2/c1-4-8-24-12-16-18(22-20(25)19(16)23(3)13-24)15-10-14(11-21)6-7-17(15)26-9-5-2/h6-7,10,18H,4-5,8-9,12-13H2,1-3H3,(H,22,25)