3-(5-azanylpentyl)-1-[(4-methoxyphenyl)methyl]-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 3-(5-azanylpentyl)-1-[(4-methoxyphenyl)methyl]-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 3-(5-aminopentyl)-1-[(4-methoxyphenyl)methyl]-6-(5-phenyl-1H-imidazol-2-yl)-2-thioxo-hexahydropyrimidin-4-one CAS Name: 3-(5-aminopentyl)-1-[(4-methoxyphenyl)methyl]-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 3-(5-aminopentyl)-1-[(4-methoxyphenyl)methyl]-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 3-(5-aminopentyl)-1-p-anisyl-6-(5-phenyl-1H-imidazol-2-yl)-2-thioxo-hexahydropyrimidin-4-one Formula: C26H31N5O2S MolecularWeight: 477.62164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(CC(=O)N(C2=S)CCCCCN)C3=NC=C(N3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(CC(=O)N(C2=S)CCCCCN)C3=NC=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C26H31N5O2S/c1-33-21-12-10-19(11-13-21)18-31-23(16-24(32)30(26(31)34)15-7-3-6-14-27)25-28-17-22(29-25)20-8-4-2-5-9-20/h2,4-5,8-13,17,23H,3,6-7,14-16,18,27H2,1H3,(H,28,29)