1-[1-(1-adamantyl)propyl]-3-[(4-methylphenyl)methyl]thiourea

Systemtic Name: 1-[1-(1-adamantyl)propyl]-3-[(4-methylphenyl)methyl]thiourea Openeye Name: 1-[1-(1-adamantyl)propyl]-3-(p-tolylmethyl)thiourea CAS Name: 1-[1-(1-adamantyl)propyl]-3-[(4-methylphenyl)methyl]thiourea IUPAC Name: 1-[1-(1-adamantyl)propyl]-3-[(4-methylphenyl)methyl]thiourea Traditional Name: 1-[1-(1-adamantyl)propyl]-3-(4-methylbenzyl)thiourea Formula: C22H32N2S MolecularWeight: 356.56788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NCC4=CC=C(C=C4)C

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NCC4=CC=C(C=C4)C

InChI

InChI=1S/C22H32N2S/c1-3-20(22-11-17-8-18(12-22)10-19(9-17)13-22)24-21(25)23-14-16-6-4-15(2)5-7-16/h4-7,17-20H,3,8-14H2,1-2H3,(H2,23,24,25)