1-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-3-(2-ethoxyphenyl)thiourea

Systemtic Name: 1-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-3-(2-ethoxyphenyl)thiourea Openeye Name: 1-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]-3-(2-ethoxyphenyl)thiourea CAS Name: 1-[[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(2-ethoxyphenyl)thiourea IUPAC Name: 1-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]-3-(2-ethoxyphenyl)thiourea Traditional Name: 1-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]-3-o-phenetyl-thiourea Formula: C18H15ClFN3O2S2 MolecularWeight: 423.912003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C18H15ClFN3O2S2/c1-2-25-13-6-4-3-5-12(13)21-18(26)23-22-17(24)16-15(19)11-8-7-10(20)9-14(11)27-16/h3-9H,2H2,1H3,(H,22,24)(H2,21,23,26)