1-[1-(1-adamantyl)propyl]-3-(2-ethylphenyl)thiourea

Systemtic Name: 1-[1-(1-adamantyl)propyl]-3-(2-ethylphenyl)thiourea Openeye Name: 1-[1-(1-adamantyl)propyl]-3-(2-ethylphenyl)thiourea CAS Name: 1-[1-(1-adamantyl)propyl]-3-(2-ethylphenyl)thiourea IUPAC Name: 1-[1-(1-adamantyl)propyl]-3-(2-ethylphenyl)thiourea Traditional Name: 1-[1-(1-adamantyl)propyl]-3-(2-ethylphenyl)thiourea Formula: C22H32N2S MolecularWeight: 356.56788

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)NC(CC)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)NC(CC)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H32N2S/c1-3-18-7-5-6-8-19(18)23-21(25)24-20(4-2)22-12-15-9-16(13-22)11-17(10-15)14-22/h5-8,15-17,20H,3-4,9-14H2,1-2H3,(H2,23,24,25)