1-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-dimethylaminoethyl)-1-[(3-methylthiophen-2-yl)methyl]thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-(2-dimethylaminoethyl)-1-[(3-methylthiophen-2-yl)methyl]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-(2-dimethylaminoethyl)-1-[(3-methyl-2-thienyl)methyl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-(2-dimethylaminoethyl)-1-[(3-methyl-2-thiophenyl)methyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-(2-dimethylaminoethyl)-1-[(3-methylthiophen-2-yl)methyl]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-(2-dimethylaminoethyl)-1-[(3-methyl-2-thienyl)methyl]thiourea Formula: C17H21ClFN3S2 MolecularWeight: 385.950143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C2=CC(=C(C=C2)F)Cl)C(=S)NCCN(C)C

Isomeric SMILES

CC1=C(SC=C1)CN(C2=CC(=C(C=C2)F)Cl)C(=S)NCCN(C)C

InChI

InChI=1S/C17H21ClFN3S2/c1-12-6-9-24-16(12)11-22(17(23)20-7-8-21(2)3)13-4-5-15(19)14(18)10-13/h4-6,9-10H,7-8,11H2,1-3H3,(H,20,23)