2-(4-methylpyrimidin-2-yl)-1-(4-pentoxyphenyl)guanidine

Systemtic Name: 2-(4-methylpyrimidin-2-yl)-1-(4-pentoxyphenyl)guanidine Openeye Name: 2-(4-methylpyrimidin-2-yl)-1-(4-pentoxyphenyl)guanidine CAS Name: 2-(4-methyl-2-pyrimidinyl)-1-(4-pentoxyphenyl)guanidine IUPAC Name: 2-(4-methylpyrimidin-2-yl)-1-(4-pentoxyphenyl)guanidine Traditional Name: 1-(4-amoxyphenyl)-2-(4-methylpyrimidin-2-yl)guanidine Formula: C17H23N5O MolecularWeight: 313.39742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=NC2=NC=CC(=N2)C)N

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)N/C(=N\C2=NC=CC(=N2)C)/N

InChI

InChI=1S/C17H23N5O/c1-3-4-5-12-23-15-8-6-14(7-9-15)21-16(18)22-17-19-11-10-13(2)20-17/h6-11H,3-5,12H2,1-2H3,(H3,18,19,20,21,22)