N-[(E)-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methylideneamino]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(E)-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methylideneamino]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[(E)-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methyleneamino]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[(E)-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxyphenyl]methylideneamino]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(E)-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]methylideneamino]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(E)-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxy-benzylidene]amino]-3-chloro-benzothiophene-2-carboxamide Formula: C25H18ClN3O2S3 MolecularWeight: 524.07732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C2=C(C3=CC=CC=C3S2)Cl)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H18ClN3O2S3/c1-31-19-11-10-15(12-16(19)14-32-25-28-18-7-3-5-9-21(18)34-25)13-27-29-24(30)23-22(26)17-6-2-4-8-20(17)33-23/h2-13H,14H2,1H3,(H,29,30)/b27-13+