1-[(E)-(4-methoxy-3-phenylmethoxy-phenyl)methylideneamino]-1-(3,3,5-trimethylcyclohexyl)thiourea

Systemtic Name: 1-[(E)-(4-methoxy-3-phenylmethoxy-phenyl)methylideneamino]-1-(3,3,5-trimethylcyclohexyl)thiourea Openeye Name: 1-[(E)-(3-benzyloxy-4-methoxy-phenyl)methyleneamino]-1-(3,3,5-trimethylcyclohexyl)thiourea CAS Name: 1-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]-1-(3,3,5-trimethylcyclohexyl)thiourea IUPAC Name: 1-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]-1-(3,3,5-trimethylcyclohexyl)thiourea Traditional Name: 1-[(E)-(3-benzoxy-4-methoxy-benzylidene)amino]-1-(3,3,5-trimethylcyclohexyl)thiourea Formula: C25H33N3O2S MolecularWeight: 439.61342

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)N(C(=S)N)N=CC2=CC(=C(C=C2)OC)OCC3=CC=CC=C3

Isomeric SMILES

CC1CC(CC(C1)(C)C)N(C(=S)N)/N=C/C2=CC(=C(C=C2)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O2S/c1-18-12-21(15-25(2,3)14-18)28(24(26)31)27-16-20-10-11-22(29-4)23(13-20)30-17-19-8-6-5-7-9-19/h5-11,13,16,18,21H,12,14-15,17H2,1-4H3,(H2,26,31)/b27-16+