1-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C17H11ClF3N3OS2 MolecularWeight: 429.86695

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NNC(=S)NC3=CC=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NNC(=S)NC3=CC=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C17H11ClF3N3OS2/c18-13-11-6-1-2-7-12(11)27-14(13)15(25)23-24-16(26)22-10-5-3-4-9(8-10)17(19,20)21/h1-8H,(H,23,25)(H2,22,24,26)