2-azanyl-4-[hydroxymethyl-[(3-phenethylcyclobutyl)methyl]amino]pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-[hydroxymethyl-[(3-phenethylcyclobutyl)methyl]amino]pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-[hydroxymethyl-[(3-phenethylcyclobutyl)methyl]amino]pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[hydroxymethyl-[(3-phenethylcyclobutyl)methyl]amino]-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-[hydroxymethyl-[(3-phenethylcyclobutyl)methyl]amino]pyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[methylol-[(3-phenethylcyclobutyl)methyl]amino]pyrimidine-5-carbonitrile Formula: C19H23N5O MolecularWeight: 337.41882

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC1CN(CO)C2=NC(=NC=C2C#N)N)CCC3=CC=CC=C3

Isomeric SMILES

C1C(CC1CN(CO)C2=NC(=NC=C2C#N)N)CCC3=CC=CC=C3

InChI

InChI=1S/C19H23N5O/c20-10-17-11-22-19(21)23-18(17)24(13-25)12-16-8-15(9-16)7-6-14-4-2-1-3-5-14/h1-5,11,15-16,25H,6-9,12-13H2,(H2,21,22,23)