3-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-(2-methylpropyl)amino]propanenitrile

Systemtic Name: 3-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-(2-methylpropyl)amino]propanenitrile Openeye Name: 3-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-isobutyl-amino]propanenitrile CAS Name: 3-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-(2-methylpropyl)amino]propanenitrile IUPAC Name: 3-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-(2-methylpropyl)amino]propanenitrile Traditional Name: 3-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-isobutyl-amino]propionitrile Formula: C15H25N5O2 MolecularWeight: 307.3913

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC#N)CC(C)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC#N)CC(C)C)N

InChI

InChI=1S/C15H25N5O2/c1-4-5-9-20-13(17)12(14(21)18-15(20)22)19(8-6-7-16)10-11(2)3/h11H,4-6,8-10,17H2,1-3H3,(H,18,21,22)