4-[2-methyl-6-[4-(N'-propylcarbamimidoyl)phenyl]pyrimidin-4-yl]-N'-propyl-benzenecarboximidamide

Systemtic Name: 4-[2-methyl-6-[4-(N'-propylcarbamimidoyl)phenyl]pyrimidin-4-yl]-N'-propyl-benzenecarboximidamide Openeye Name: 4-[2-methyl-6-[4-(N'-propylcarbamimidoyl)phenyl]pyrimidin-4-yl]-N'-propyl-benzamidine CAS Name: 4-[6-[4-[amino(propylimino)methyl]phenyl]-2-methyl-4-pyrimidinyl]-N'-propylbenzenecarboximidamide IUPAC Name: 4-[2-methyl-6-[4-(N'-propylcarbamimidoyl)phenyl]pyrimidin-4-yl]-N'-propylbenzenecarboximidamide Traditional Name: 4-[2-methyl-6-[4-(N'-propylamidino)phenyl]pyrimidin-4-yl]-N'-propyl-benzamidine Formula: C25H30N6 MolecularWeight: 414.5459

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(C1=CC=C(C=C1)C2=CC(=NC(=N2)C)C3=CC=C(C=C3)C(=NCCC)N)N

Isomeric SMILES

CCCN=C(C1=CC=C(C=C1)C2=CC(=NC(=N2)C)C3=CC=C(C=C3)C(=NCCC)N)N

InChI

InChI=1S/C25H30N6/c1-4-14-28-24(26)20-10-6-18(7-11-20)22-16-23(31-17(3)30-22)19-8-12-21(13-9-19)25(27)29-15-5-2/h6-13,16H,4-5,14-15H2,1-3H3,(H2,26,28)(H2,27,29)