2-[[6-[(3R)-3-azanylpiperidin-1-yl]-3-ethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[6-[(3R)-3-azanylpiperidin-1-yl]-3-ethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[6-[(3R)-3-amino-1-piperidyl]-3-ethyl-2,4-dioxo-pyrimidin-1-yl]methyl]benzonitrile CAS Name: 2-[[6-[(3R)-3-amino-1-piperidinyl]-3-ethyl-2,4-dioxo-1-pyrimidinyl]methyl]benzonitrile IUPAC Name: 2-[[6-[(3R)-3-aminopiperidin-1-yl]-3-ethyl-2,4-dioxopyrimidin-1-yl]methyl]benzonitrile Traditional Name: 2-[[6-[(3R)-3-aminopiperidino]-3-ethyl-2,4-diketo-pyrimidin-1-yl]methyl]benzonitrile Formula: C19H23N5O2 MolecularWeight: 353.41822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=C(N(C1=O)CC2=CC=CC=C2C#N)N3CCCC(C3)N

Isomeric SMILES

CCN1C(=O)C=C(N(C1=O)CC2=CC=CC=C2C#N)N3CCC[C@H](C3)N

InChI

InChI=1S/C19H23N5O2/c1-2-23-18(25)10-17(22-9-5-8-16(21)13-22)24(19(23)26)12-15-7-4-3-6-14(15)11-20/h3-4,6-7,10,16H,2,5,8-9,12-13,21H2,1H3/t16-/m1/s1