1-(1-adamantyl)-3-[(E)-(2,4,5-triethoxyphenyl)methylideneamino]thiourea

Systemtic Name: 1-(1-adamantyl)-3-[(E)-(2,4,5-triethoxyphenyl)methylideneamino]thiourea Openeye Name: 1-(1-adamantyl)-3-[(E)-(2,4,5-triethoxyphenyl)methyleneamino]thiourea CAS Name: 1-(1-adamantyl)-3-[(E)-(2,4,5-triethoxyphenyl)methylideneamino]thiourea IUPAC Name: 1-(1-adamantyl)-3-[(E)-(2,4,5-triethoxyphenyl)methylideneamino]thiourea Traditional Name: 1-(1-adamantyl)-3-[(E)-(2,4,5-triethoxybenzylidene)amino]thiourea Formula: C24H35N3O3S MolecularWeight: 445.618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C=NNC(=S)NC23CC4CC(C2)CC(C4)C3)OCC)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1/C=N/NC(=S)NC23CC4CC(C2)CC(C4)C3)OCC)OCC

InChI

InChI=1S/C24H35N3O3S/c1-4-28-20-11-22(30-6-3)21(29-5-2)10-19(20)15-25-27-23(31)26-24-12-16-7-17(13-24)9-18(8-16)14-24/h10-11,15-18H,4-9,12-14H2,1-3H3,(H2,26,27,31)/b25-15+