1-(4-butylphenyl)-3-[2-(5-chloranyl-2-methoxy-phenyl)ethanoylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[2-(5-chloranyl-2-methoxy-phenyl)ethanoylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[2-(5-chloro-2-methoxy-phenyl)acetyl]amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[2-(5-chloro-2-methoxyphenyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[2-(5-chloro-2-methoxyphenyl)acetyl]amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[[2-(5-chloro-2-methoxy-phenyl)acetyl]amino]thiourea Formula: C20H24ClN3O2S MolecularWeight: 405.94146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C20H24ClN3O2S/c1-3-4-5-14-6-9-17(10-7-14)22-20(27)24-23-19(25)13-15-12-16(21)8-11-18(15)26-2/h6-12H,3-5,13H2,1-2H3,(H,23,25)(H2,22,24,27)