1-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-3-(3,5-dimethoxyphenyl)thiourea

Systemtic Name: 1-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-3-(3,5-dimethoxyphenyl)thiourea Openeye Name: 1-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]-3-(3,5-dimethoxyphenyl)thiourea CAS Name: 1-[[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(3,5-dimethoxyphenyl)thiourea IUPAC Name: 1-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]-3-(3,5-dimethoxyphenyl)thiourea Traditional Name: 1-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]-3-(3,5-dimethoxyphenyl)thiourea Formula: C18H15ClFN3O3S2 MolecularWeight: 439.911403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl)OC

InChI

InChI=1S/C18H15ClFN3O3S2/c1-25-11-6-10(7-12(8-11)26-2)21-18(27)23-22-17(24)16-15(19)13-4-3-9(20)5-14(13)28-16/h3-8H,1-2H3,(H,22,24)(H2,21,23,27)