1-(2-adamantyl)-3-(3,4-dimethylphenyl)thiourea

Systemtic Name: 1-(2-adamantyl)-3-(3,4-dimethylphenyl)thiourea Openeye Name: 1-(2-adamantyl)-3-(3,4-dimethylphenyl)thiourea CAS Name: 1-(2-adamantyl)-3-(3,4-dimethylphenyl)thiourea IUPAC Name: 1-(2-adamantyl)-3-(3,4-dimethylphenyl)thiourea Traditional Name: 1-(2-adamantyl)-3-(3,4-dimethylphenyl)thiourea Formula: C19H26N2S MolecularWeight: 314.48814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2C3CC4CC(C3)CC2C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2C3CC4CC(C3)CC2C4)C

InChI

InChI=1S/C19H26N2S/c1-11-3-4-17(5-12(11)2)20-19(22)21-18-15-7-13-6-14(9-15)10-16(18)8-13/h3-5,13-16,18H,6-10H2,1-2H3,(H2,20,21,22)