1-[1-(1-adamantyl)propyl]-3-(4-ethylphenyl)thiourea

Systemtic Name: 1-[1-(1-adamantyl)propyl]-3-(4-ethylphenyl)thiourea Openeye Name: 1-[1-(1-adamantyl)propyl]-3-(4-ethylphenyl)thiourea CAS Name: 1-[1-(1-adamantyl)propyl]-3-(4-ethylphenyl)thiourea IUPAC Name: 1-[1-(1-adamantyl)propyl]-3-(4-ethylphenyl)thiourea Traditional Name: 1-[1-(1-adamantyl)propyl]-3-(4-ethylphenyl)thiourea Formula: C22H32N2S MolecularWeight: 356.56788

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NC(CC)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NC(CC)C23CC4CC(C2)CC(C4)C3

InChI

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