1-[1-(3-methoxy-4-oxidanyl-phenyl)pentan-3-yl]-3-phenethyl-thiourea

Systemtic Name: 1-[1-(3-methoxy-4-oxidanyl-phenyl)pentan-3-yl]-3-phenethyl-thiourea Openeye Name: 1-[1-ethyl-3-(4-hydroxy-3-methoxy-phenyl)propyl]-3-phenethyl-thiourea CAS Name: 1-[1-(4-hydroxy-3-methoxyphenyl)pentan-3-yl]-3-phenethylthiourea IUPAC Name: 1-[1-(4-hydroxy-3-methoxyphenyl)pentan-3-yl]-3-phenethylthiourea Traditional Name: 1-[1-ethyl-3-(4-hydroxy-3-methoxy-phenyl)propyl]-3-phenethyl-thiourea Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC(=C(C=C1)O)OC)NC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

CCC(CCC1=CC(=C(C=C1)O)OC)NC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C21H28N2O2S/c1-3-18(11-9-17-10-12-19(24)20(15-17)25-2)23-21(26)22-14-13-16-7-5-4-6-8-16/h4-8,10,12,15,18,24H,3,9,11,13-14H2,1-2H3,(H2,22,23,26)