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

Systemtic Name: 3-(6-azanylhexyl)-1-[(4-methoxyphenyl)methyl]-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 3-(6-aminohexyl)-1-[(4-methoxyphenyl)methyl]-6-(5-phenyl-1H-imidazol-2-yl)-2-thioxo-hexahydropyrimidin-4-one CAS Name: 3-(6-aminohexyl)-1-[(4-methoxyphenyl)methyl]-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 3-(6-aminohexyl)-1-[(4-methoxyphenyl)methyl]-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 3-(6-aminohexyl)-1-p-anisyl-6-(5-phenyl-1H-imidazol-2-yl)-2-thioxo-hexahydropyrimidin-4-one Formula: C27H33N5O2S MolecularWeight: 491.64822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33N5O2S/c1-34-22-13-11-20(12-14-22)19-32-24(26-29-18-23(30-26)21-9-5-4-6-10-21)17-25(33)31(27(32)35)16-8-3-2-7-15-28/h4-6,9-14,18,24H,2-3,7-8,15-17,19,28H2,1H3,(H,29,30)