2-[[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-(2-methoxyethyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 2-[[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-(2-methoxyethyl)amino]methyl]benzenecarbonitrile Openeye Name: 2-[[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-(2-methoxyethyl)amino]methyl]benzonitrile CAS Name: 2-[[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-(2-methoxyethyl)amino]methyl]benzonitrile IUPAC Name: 2-[[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-(2-methoxyethyl)amino]methyl]benzonitrile Traditional Name: 2-[[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-(2-methoxyethyl)amino]methyl]benzonitrile Formula: C19H25N5O3 MolecularWeight: 371.4335

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)CC2=CC=CC=C2C#N)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)CC2=CC=CC=C2C#N)N

InChI

InChI=1S/C19H25N5O3/c1-3-4-9-24-17(21)16(18(25)22-19(24)26)23(10-11-27-2)13-15-8-6-5-7-14(15)12-20/h5-8H,3-4,9-11,13,21H2,1-2H3,(H,22,25,26)