1-(2-fluorophenyl)-3-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]thiourea

Systemtic Name: 1-(2-fluorophenyl)-3-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]thiourea Openeye Name: 1-(2-fluorophenyl)-3-[[(5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]thiourea CAS Name: 1-(2-fluorophenyl)-3-[[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]amino]thiourea IUPAC Name: 1-(2-fluorophenyl)-3-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]amino]thiourea Traditional Name: 1-(2-fluorophenyl)-3-[[(5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]thiourea Formula: C17H18FN3OS2 MolecularWeight: 363.472723

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=S)NC3=CC=CC=C3F

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=S)NC3=CC=CC=C3F

InChI

InChI=1S/C17H18FN3OS2/c1-10-6-7-14-11(8-10)9-15(24-14)16(22)20-21-17(23)19-13-5-3-2-4-12(13)18/h2-5,9-10H,6-8H2,1H3,(H,20,22)(H2,19,21,23)/t10-/m0/s1