1-[2-(4-bromanyl-2-chloranyl-phenoxy)propanoylamino]-3-phenethyl-thiourea

Systemtic Name: 1-[2-(4-bromanyl-2-chloranyl-phenoxy)propanoylamino]-3-phenethyl-thiourea Openeye Name: 1-[2-(4-bromo-2-chloro-phenoxy)propanoylamino]-3-phenethyl-thiourea CAS Name: 1-[[2-(4-bromo-2-chlorophenoxy)-1-oxopropyl]amino]-3-phenethylthiourea IUPAC Name: 1-[2-(4-bromo-2-chlorophenoxy)propanoylamino]-3-phenethylthiourea Traditional Name: 1-[2-(4-bromo-2-chloro-phenoxy)propanoylamino]-3-phenethyl-thiourea Formula: C18H19BrClN3O2S MolecularWeight: 456.78436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NCCC1=CC=CC=C1)OC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CC(C(=O)NNC(=S)NCCC1=CC=CC=C1)OC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C18H19BrClN3O2S/c1-12(25-16-8-7-14(19)11-15(16)20)17(24)22-23-18(26)21-10-9-13-5-3-2-4-6-13/h2-8,11-12H,9-10H2,1H3,(H,22,24)(H2,21,23,26)