1-[4-(1-adamantyl)phenyl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 1-[4-(1-adamantyl)phenyl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 1-[4-(1-adamantyl)phenyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-[4-(1-adamantyl)phenyl]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-[4-(1-adamantyl)phenyl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-[4-(1-adamantyl)phenyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C22H30N2OS MolecularWeight: 370.5514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1C[C@@H](OC1)CNC(=S)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H30N2OS/c26-21(23-14-20-2-1-7-25-20)24-19-5-3-18(4-6-19)22-11-15-8-16(12-22)10-17(9-15)13-22/h3-6,15-17,20H,1-2,7-14H2,(H2,23,24,26)/t15?,16?,17?,20-,22?/m1/s1