3-(6-azanylhexyl)-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1-(thiophen-3-ylmethyl)-1,3-diazinan-4-one

Systemtic Name: 3-(6-azanylhexyl)-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1-(thiophen-3-ylmethyl)-1,3-diazinan-4-one Openeye Name: 3-(6-aminohexyl)-6-(5-phenyl-1H-imidazol-2-yl)-1-(3-thienylmethyl)-2-thioxo-hexahydropyrimidin-4-one CAS Name: 3-(6-aminohexyl)-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1-(3-thiophenylmethyl)-1,3-diazinan-4-one IUPAC Name: 3-(6-aminohexyl)-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1-(thiophen-3-ylmethyl)-1,3-diazinan-4-one Traditional Name: 3-(6-aminohexyl)-6-(5-phenyl-1H-imidazol-2-yl)-1-(3-thenyl)-2-thioxo-hexahydropyrimidin-4-one Formula: C24H29N5OS2 MolecularWeight: 467.64996

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(=S)N(C1=O)CCCCCCN)CC2=CSC=C2)C3=NC=C(N3)C4=CC=CC=C4

Isomeric SMILES

C1C(N(C(=S)N(C1=O)CCCCCCN)CC2=CSC=C2)C3=NC=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C24H29N5OS2/c25-11-6-1-2-7-12-28-22(30)14-21(29(24(28)31)16-18-10-13-32-17-18)23-26-15-20(27-23)19-8-4-3-5-9-19/h3-5,8-10,13,15,17,21H,1-2,6-7,11-12,14,16,25H2,(H,26,27)