1-(2-adamantyl)-3-(4-bromanyl-3-methyl-phenyl)thiourea

Systemtic Name: 1-(2-adamantyl)-3-(4-bromanyl-3-methyl-phenyl)thiourea Openeye Name: 1-(2-adamantyl)-3-(4-bromo-3-methyl-phenyl)thiourea CAS Name: 1-(2-adamantyl)-3-(4-bromo-3-methylphenyl)thiourea IUPAC Name: 1-(2-adamantyl)-3-(4-bromo-3-methylphenyl)thiourea Traditional Name: 1-(2-adamantyl)-3-(4-bromo-3-methyl-phenyl)thiourea Formula: C18H23BrN2S MolecularWeight: 379.35762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23BrN2S/c1-10-4-15(2-3-16(10)19)20-18(22)21-17-13-6-11-5-12(8-13)9-14(17)7-11/h2-4,11-14,17H,5-9H2,1H3,(H2,20,21,22)