1-(1-adamantyl)-1-methyl-3-(phenylmethyl)thiourea

Systemtic Name: 1-(1-adamantyl)-1-methyl-3-(phenylmethyl)thiourea Openeye Name: 1-(1-adamantyl)-3-benzyl-1-methyl-thiourea CAS Name: 1-(1-adamantyl)-1-methyl-3-(phenylmethyl)thiourea IUPAC Name: 1-(1-adamantyl)-3-benzyl-1-methylthiourea Traditional Name: 1-(1-adamantyl)-3-benzyl-1-methyl-thiourea Formula: C19H26N2S MolecularWeight: 314.48814

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC1=CC=CC=C1)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C(=S)NCC1=CC=CC=C1)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H26N2S/c1-21(18(22)20-13-14-5-3-2-4-6-14)19-10-15-7-16(11-19)9-17(8-15)12-19/h2-6,15-17H,7-13H2,1H3,(H,20,22)