1-[[1-(3-chloranyl-4-fluoranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-ethyl-thiourea

Systemtic Name: 1-[[1-(3-chloranyl-4-fluoranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-ethyl-thiourea Openeye Name: 1-[[1-(3-chloro-4-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-ethyl-thiourea CAS Name: 1-[[1-(3-chloro-4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-ethylthiourea IUPAC Name: 1-[[1-(3-chloro-4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-3-ethylthiourea Traditional Name: 1-[[1-(3-chloro-4-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-ethyl-thiourea Formula: C16H18ClFN4S MolecularWeight: 352.857323

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=C(N(C(=C1)C)C2=CC(=C(C=C2)F)Cl)C

Isomeric SMILES

CCNC(=S)NN=CC1=C(N(C(=C1)C)C2=CC(=C(C=C2)F)Cl)C

InChI

InChI=1S/C16H18ClFN4S/c1-4-19-16(23)21-20-9-12-7-10(2)22(11(12)3)13-5-6-15(18)14(17)8-13/h5-9H,4H2,1-3H3,(H2,19,21,23)