(E)-4-(benzotriazol-1-yl)-5-(2-chlorophenyl)-N-phenyl-pent-3-enethioamide

Systemtic Name: (E)-4-(benzotriazol-1-yl)-5-(2-chlorophenyl)-N-phenyl-pent-3-enethioamide Openeye Name: (E)-4-(benzotriazol-1-yl)-5-(2-chlorophenyl)-N-phenyl-pent-3-enethioamide CAS Name: (E)-4-(1-benzotriazolyl)-5-(2-chlorophenyl)-N-phenyl-3-pentenethioamide IUPAC Name: (E)-4-(benzotriazol-1-yl)-5-(2-chlorophenyl)-N-phenylpent-3-enethioamide Traditional Name: (E)-4-(benzotriazol-1-yl)-5-(2-chlorophenyl)-N-phenyl-pent-3-enethioamide Formula: C23H19ClN4S MolecularWeight: 418.94176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)CC=C(CC2=CC=CC=C2Cl)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)C/C=C(\CC2=CC=CC=C2Cl)/N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C23H19ClN4S/c24-20-11-5-4-8-17(20)16-19(28-22-13-7-6-12-21(22)26-27-28)14-15-23(29)25-18-9-2-1-3-10-18/h1-14H,15-16H2,(H,25,29)/b19-14+