1-(5-chloranyl-2-methoxy-phenyl)-3-(3-methylbutanoylamino)thiourea

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-(3-methylbutanoylamino)thiourea Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-(3-methylbutanoylamino)thiourea CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-[(3-methyl-1-oxobutyl)amino]thiourea IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-(3-methylbutanoylamino)thiourea Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-(isovalerylamino)thiourea Formula: C13H18ClN3O2S MolecularWeight: 315.81892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=S)NC1=C(C=CC(=C1)Cl)OC

Isomeric SMILES

CC(C)CC(=O)NNC(=S)NC1=C(C=CC(=C1)Cl)OC

InChI

InChI=1S/C13H18ClN3O2S/c1-8(2)6-12(18)16-17-13(20)15-10-7-9(14)4-5-11(10)19-3/h4-5,7-8H,6H2,1-3H3,(H,16,18)(H2,15,17,20)