1-[1-(1-adamantyl)ethyl]-3-(4-bromanyl-2-chloranyl-phenyl)thiourea

Systemtic Name: 1-[1-(1-adamantyl)ethyl]-3-(4-bromanyl-2-chloranyl-phenyl)thiourea Openeye Name: 1-[1-(1-adamantyl)ethyl]-3-(4-bromo-2-chloro-phenyl)thiourea CAS Name: 1-[1-(1-adamantyl)ethyl]-3-(4-bromo-2-chlorophenyl)thiourea IUPAC Name: 1-[1-(1-adamantyl)ethyl]-3-(4-bromo-2-chlorophenyl)thiourea Traditional Name: 1-[1-(1-adamantyl)ethyl]-3-(4-bromo-2-chloro-phenyl)thiourea Formula: C19H24BrClN2S MolecularWeight: 427.82926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C19H24BrClN2S/c1-11(19-8-12-4-13(9-19)6-14(5-12)10-19)22-18(24)23-17-3-2-15(20)7-16(17)21/h2-3,7,11-14H,4-6,8-10H2,1H3,(H2,22,23,24)