1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-[3-phenyl-2-(phenylmethoxymethyl)propyl]thiourea

Systemtic Name: 1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-[3-phenyl-2-(phenylmethoxymethyl)propyl]thiourea Openeye Name: 1-(2-benzyl-3-benzyloxy-propyl)-3-[(4-hydroxy-3-methoxy-phenyl)methyl]thiourea CAS Name: 1-[(4-hydroxy-3-methoxyphenyl)methyl]-3-[3-phenyl-2-(phenylmethoxymethyl)propyl]thiourea IUPAC Name: 1-(2-benzyl-3-phenylmethoxypropyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]thiourea Traditional Name: 1-[2-(benzoxymethyl)-3-phenyl-propyl]-3-vanillyl-thiourea Formula: C26H30N2O3S MolecularWeight: 450.593

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=S)NCC(CC2=CC=CC=C2)COCC3=CC=CC=C3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=S)NCC(CC2=CC=CC=C2)COCC3=CC=CC=C3)O

InChI

InChI=1S/C26H30N2O3S/c1-30-25-15-22(12-13-24(25)29)16-27-26(32)28-17-23(14-20-8-4-2-5-9-20)19-31-18-21-10-6-3-7-11-21/h2-13,15,23,29H,14,16-19H2,1H3,(H2,27,28,32)