1-[1-(1-adamantyl)butyl]-3-(2-methoxy-5-methyl-phenyl)thiourea

Systemtic Name: 1-[1-(1-adamantyl)butyl]-3-(2-methoxy-5-methyl-phenyl)thiourea Openeye Name: 1-[1-(1-adamantyl)butyl]-3-(2-methoxy-5-methyl-phenyl)thiourea CAS Name: 1-[1-(1-adamantyl)butyl]-3-(2-methoxy-5-methylphenyl)thiourea IUPAC Name: 1-[1-(1-adamantyl)butyl]-3-(2-methoxy-5-methylphenyl)thiourea Traditional Name: 1-[1-(1-adamantyl)butyl]-3-(2-methoxy-5-methyl-phenyl)thiourea Formula: C23H34N2OS MolecularWeight: 386.59386

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=C(C=CC(=C4)C)OC

Isomeric SMILES

CCCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=C(C=CC(=C4)C)OC

InChI

InChI=1S/C23H34N2OS/c1-4-5-21(23-12-16-9-17(13-23)11-18(10-16)14-23)25-22(27)24-19-8-15(2)6-7-20(19)26-3/h6-8,16-18,21H,4-5,9-14H2,1-3H3,(H2,24,25,27)