1-[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[(2S)-2-(4-cyanophenoxy)-1-oxopropyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C(C)OC2=CC=C(C=C2)C#N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)[C@H](C)OC2=CC=C(C=C2)C#N)C

InChI

InChI=1S/C20H22N4O2S/c1-4-16-7-5-6-13(2)18(16)22-20(27)24-23-19(25)14(3)26-17-10-8-15(12-21)9-11-17/h5-11,14H,4H2,1-3H3,(H,23,25)(H2,22,24,27)/t14-/m0/s1