1-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-3-methyl-thiourea

Systemtic Name: 1-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-3-methyl-thiourea Openeye Name: 1-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-3-methyl-thiourea CAS Name: 1-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]-3-methylthiourea IUPAC Name: 1-[4-(4-chloro-2-methylphenoxy)butanoylamino]-3-methylthiourea Traditional Name: 1-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-3-methyl-thiourea Formula: C13H18ClN3O2S MolecularWeight: 315.81892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=S)NC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=S)NC

InChI

InChI=1S/C13H18ClN3O2S/c1-9-8-10(14)5-6-11(9)19-7-3-4-12(18)16-17-13(20)15-2/h5-6,8H,3-4,7H2,1-2H3,(H,16,18)(H2,15,17,20)