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

Systemtic Name: 1-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]thiourea CAS Name: 1-[[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]thiourea Traditional Name: 1-benzyl-3-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]thiourea Formula: C17H13ClFN3OS2 MolecularWeight: 393.886023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C17H13ClFN3OS2/c18-14-12-7-6-11(19)8-13(12)25-15(14)16(23)21-22-17(24)20-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,21,23)(H2,20,22,24)