6-[(4-octylphenyl)amino]-1-[(4-propan-2-yl-1H-pyrrol-2-yl)methyl]pyrimidine-2,4-dione

Systemtic Name: 6-[(4-octylphenyl)amino]-1-[(4-propan-2-yl-1H-pyrrol-2-yl)methyl]pyrimidine-2,4-dione Openeye Name: 1-[(4-isopropyl-1H-pyrrol-2-yl)methyl]-6-(4-octylanilino)pyrimidine-2,4-dione CAS Name: 6-(4-octylanilino)-1-[(4-propan-2-yl-1H-pyrrol-2-yl)methyl]pyrimidine-2,4-dione IUPAC Name: 6-(4-octylanilino)-1-[(4-propan-2-yl-1H-pyrrol-2-yl)methyl]pyrimidine-2,4-dione Traditional Name: 1-[(4-isopropyl-1H-pyrrol-2-yl)methyl]-6-(4-octylanilino)pyrimidine-2,4-quinone Formula: C26H36N4O2 MolecularWeight: 436.58964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)NC2=CC(=O)NC(=O)N2CC3=CC(=CN3)C(C)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)NC2=CC(=O)NC(=O)N2CC3=CC(=CN3)C(C)C

InChI

InChI=1S/C26H36N4O2/c1-4-5-6-7-8-9-10-20-11-13-22(14-12-20)28-24-16-25(31)29-26(32)30(24)18-23-15-21(17-27-23)19(2)3/h11-17,19,27-28H,4-10,18H2,1-3H3,(H,29,31,32)