1-[[3-[(4-cyanophenoxy)methyl]phenyl]carbonylamino]-3-(3-ethoxypropyl)thiourea

Systemtic Name: 1-[[3-[(4-cyanophenoxy)methyl]phenyl]carbonylamino]-3-(3-ethoxypropyl)thiourea Openeye Name: 1-[[3-[(4-cyanophenoxy)methyl]benzoyl]amino]-3-(3-ethoxypropyl)thiourea CAS Name: 1-[[[3-[(4-cyanophenoxy)methyl]phenyl]-oxomethyl]amino]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-[[3-[(4-cyanophenoxy)methyl]benzoyl]amino]-3-(3-ethoxypropyl)thiourea Traditional Name: 1-[[3-[(4-cyanophenoxy)methyl]benzoyl]amino]-3-(3-ethoxypropyl)thiourea Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NNC(=O)C1=CC(=CC=C1)COC2=CC=C(C=C2)C#N

Isomeric SMILES

CCOCCCNC(=S)NNC(=O)C1=CC(=CC=C1)COC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H24N4O3S/c1-2-27-12-4-11-23-21(29)25-24-20(26)18-6-3-5-17(13-18)15-28-19-9-7-16(14-22)8-10-19/h3,5-10,13H,2,4,11-12,15H2,1H3,(H,24,26)(H2,23,25,29)