5-chloranyl-N-[(E)-1-[4-[(2-methylphenyl)carbonylamino]phenyl]ethylideneamino]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[(E)-1-[4-[(2-methylphenyl)carbonylamino]phenyl]ethylideneamino]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[(E)-1-[4-[(2-methylbenzoyl)amino]phenyl]ethylideneamino]thiophene-2-carboxamide CAS Name: 5-chloro-N-[(E)-1-[4-[[(2-methylphenyl)-oxomethyl]amino]phenyl]ethylideneamino]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[(E)-1-[4-[(2-methylbenzoyl)amino]phenyl]ethylideneamino]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[(E)-1-[4-(o-toluoylamino)phenyl]ethylideneamino]thiophene-2-carboxamide Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=NNC(=O)C3=CC=C(S3)Cl)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)/C(=N/NC(=O)C3=CC=C(S3)Cl)/C

InChI

InChI=1S/C21H18ClN3O2S/c1-13-5-3-4-6-17(13)20(26)23-16-9-7-15(8-10-16)14(2)24-25-21(27)18-11-12-19(22)28-18/h3-12H,1-2H3,(H,23,26)(H,25,27)/b24-14+