3-(5-azanylpentyl)-1-(cyclohexylmethyl)-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 3-(5-azanylpentyl)-1-(cyclohexylmethyl)-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 3-(5-aminopentyl)-1-(cyclohexylmethyl)-6-(5-phenyl-1H-imidazol-2-yl)-2-thioxo-hexahydropyrimidin-4-one CAS Name: 3-(5-aminopentyl)-1-(cyclohexylmethyl)-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 3-(5-aminopentyl)-1-(cyclohexylmethyl)-6-(5-phenyl-1H-imidazol-2-yl)-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 3-(5-aminopentyl)-1-(cyclohexylmethyl)-6-(5-phenyl-1H-imidazol-2-yl)-2-thioxo-hexahydropyrimidin-4-one Formula: C25H35N5OS MolecularWeight: 453.6433

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C(CC(=O)N(C2=S)CCCCCN)C3=NC=C(N3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CN2C(CC(=O)N(C2=S)CCCCCN)C3=NC=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C25H35N5OS/c26-14-8-3-9-15-29-23(31)16-22(30(25(29)32)18-19-10-4-1-5-11-19)24-27-17-21(28-24)20-12-6-2-7-13-20/h2,6-7,12-13,17,19,22H,1,3-5,8-11,14-16,18,26H2,(H,27,28)