1-(2-methylpropyl)-5-pent-4-en-2-yl-3-[4-phenyl-3-(phenylmethyl)-1,2-thiazol-5-yl]-1,3,5-triazinan-2-one

Systemtic Name: 1-(2-methylpropyl)-5-pent-4-en-2-yl-3-[4-phenyl-3-(phenylmethyl)-1,2-thiazol-5-yl]-1,3,5-triazinan-2-one Openeye Name: 1-(3-benzyl-4-phenyl-isothiazol-5-yl)-3-isobutyl-5-(1-methylbut-3-enyl)-1,3,5-triazinan-2-one CAS Name: 1-(2-methylpropyl)-5-pent-4-en-2-yl-3-[4-phenyl-3-(phenylmethyl)-5-isothiazolyl]-1,3,5-triazinan-2-one IUPAC Name: 1-(3-benzyl-4-phenyl-1,2-thiazol-5-yl)-3-(2-methylpropyl)-5-pent-4-en-2-yl-1,3,5-triazinan-2-one Traditional Name: 1-(3-benzyl-4-phenyl-isothiazol-5-yl)-3-isobutyl-5-(1-methylbut-3-enyl)-1,3,5-triazinan-2-one Formula: C28H34N4OS MolecularWeight: 474.66076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CN(CN(C1=O)C2=C(C(=NS2)CC3=CC=CC=C3)C4=CC=CC=C4)C(C)CC=C

Isomeric SMILES

CC(C)CN1CN(CN(C1=O)C2=C(C(=NS2)CC3=CC=CC=C3)C4=CC=CC=C4)C(C)CC=C

InChI

InChI=1S/C28H34N4OS/c1-5-12-22(4)31-19-30(18-21(2)3)28(33)32(20-31)27-26(24-15-10-7-11-16-24)25(29-34-27)17-23-13-8-6-9-14-23/h5-11,13-16,21-22H,1,12,17-20H2,2-4H3