(5E)-5-(5-chloranyl-3-phenyl-indol-2-ylidene)-4-phenyl-2-(piperidin-1-ylmethyl)-1,2,4-triazolidine-3-thione

Systemtic Name: (5E)-5-(5-chloranyl-3-phenyl-indol-2-ylidene)-4-phenyl-2-(piperidin-1-ylmethyl)-1,2,4-triazolidine-3-thione Openeye Name: (5E)-5-(5-chloro-3-phenyl-indol-2-ylidene)-4-phenyl-2-(1-piperidylmethyl)-1,2,4-triazolidine-3-thione CAS Name: (5E)-5-(5-chloro-3-phenyl-2-indolylidene)-4-phenyl-2-(1-piperidinylmethyl)-1,2,4-triazolidine-3-thione IUPAC Name: (5E)-5-(5-chloro-3-phenylindol-2-ylidene)-4-phenyl-2-(piperidin-1-ylmethyl)-1,2,4-triazolidine-3-thione Traditional Name: (5E)-5-(5-chloro-3-phenyl-indol-2-ylidene)-4-phenyl-2-(piperidinomethyl)-1,2,4-triazolidine-3-thione Formula: C28H26ClN5S MolecularWeight: 500.05754

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CN2C(=S)N(C(=C3C(=C4C=C(C=CC4=N3)Cl)C5=CC=CC=C5)N2)C6=CC=CC=C6

Isomeric SMILES

C1CCN(CC1)CN2C(=S)N(/C(=C\3/C(=C4C=C(C=CC4=N3)Cl)C5=CC=CC=C5)/N2)C6=CC=CC=C6

InChI

InChI=1S/C28H26ClN5S/c29-21-14-15-24-23(18-21)25(20-10-4-1-5-11-20)26(30-24)27-31-33(19-32-16-8-3-9-17-32)28(35)34(27)22-12-6-2-7-13-22/h1-2,4-7,10-15,18,31H,3,8-9,16-17,19H2/b27-26-