N-benzo[e][1,3]benzothiazol-2-yl-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-3-[(1H-1,2,4-triazol-5-ylthio)methyl]coumarilamide Formula: C23H15N5O2S2 MolecularWeight: 457.5275

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N=C(S3)NC(=O)C4=C(C5=CC=CC=C5O4)CSC6=NC=NN6

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N=C(S3)NC(=O)C4=C(C5=CC=CC=C5O4)CSC6=NC=NN6

InChI

InChI=1S/C23H15N5O2S2/c29-21(27-23-26-19-14-6-2-1-5-13(14)9-10-18(19)32-23)20-16(11-31-22-24-12-25-28-22)15-7-3-4-8-17(15)30-20/h1-10,12H,11H2,(H,24,25,28)(H,26,27,29)