1-[1-(2,4-dimethylpyrrol-3-ylidene)ethylamino]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[1-(2,4-dimethylpyrrol-3-ylidene)ethylamino]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[1-(2,4-dimethylpyrrol-3-ylidene)ethylamino]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[1-(2,4-dimethyl-3-pyrrolylidene)ethylamino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[1-(2,4-dimethylpyrrol-3-ylidene)ethylamino]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[1-(2,4-dimethylpyrrol-3-ylidene)ethylamino]-3-(4-fluorobenzyl)thiourea Formula: C16H19FN4S MolecularWeight: 318.412263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C1=C(C)NNC(=S)NCC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=CN=C(C1=C(C)NNC(=S)NCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C16H19FN4S/c1-10-8-18-11(2)15(10)12(3)20-21-16(22)19-9-13-4-6-14(17)7-5-13/h4-8,20H,9H2,1-3H3,(H2,19,21,22)