3-chloranyl-6-ethyl-N-[(E)-1-[3-(2-methylpropanoylamino)phenyl]ethylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-ethyl-N-[(E)-1-[3-(2-methylpropanoylamino)phenyl]ethylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-ethyl-N-[(E)-1-[3-(2-methylpropanoylamino)phenyl]ethylideneamino]benzothiophene-2-carboxamide CAS Name: 3-chloro-6-ethyl-N-[(E)-1-[3-[(2-methyl-1-oxopropyl)amino]phenyl]ethylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-ethyl-N-[(E)-1-[3-(2-methylpropanoylamino)phenyl]ethylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-ethyl-N-[(E)-1-[3-(isobutyrylamino)phenyl]ethylideneamino]benzothiophene-2-carboxamide Formula: C23H24ClN3O2S MolecularWeight: 441.97356

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=C(S2)C(=O)NN=C(C)C3=CC(=CC=C3)NC(=O)C(C)C)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=C(S2)C(=O)N/N=C(\C)/C3=CC(=CC=C3)NC(=O)C(C)C)Cl

InChI

InChI=1S/C23H24ClN3O2S/c1-5-15-9-10-18-19(11-15)30-21(20(18)24)23(29)27-26-14(4)16-7-6-8-17(12-16)25-22(28)13(2)3/h6-13H,5H2,1-4H3,(H,25,28)(H,27,29)/b26-14+