1-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-3-(2-methoxy-5-methyl-phenyl)thiourea

Systemtic Name: 1-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-3-(2-methoxy-5-methyl-phenyl)thiourea Openeye Name: 1-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-3-(2-methoxy-5-methyl-phenyl)thiourea CAS Name: 1-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]-3-(2-methoxy-5-methylphenyl)thiourea IUPAC Name: 1-[4-(4-chloro-2-methylphenoxy)butanoylamino]-3-(2-methoxy-5-methylphenyl)thiourea Traditional Name: 1-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-3-(2-methoxy-5-methyl-phenyl)thiourea Formula: C20H24ClN3O3S MolecularWeight: 421.94086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C20H24ClN3O3S/c1-13-6-8-18(26-3)16(11-13)22-20(28)24-23-19(25)5-4-10-27-17-9-7-15(21)12-14(17)2/h6-9,11-12H,4-5,10H2,1-3H3,(H,23,25)(H2,22,24,28)