(5Z)-5-(5-bromanyl-3-phenyl-indol-2-ylidene)-4-phenyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazolidine-3-thione

Systemtic Name: (5Z)-5-(5-bromanyl-3-phenyl-indol-2-ylidene)-4-phenyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazolidine-3-thione Openeye Name: (5Z)-5-(5-bromo-3-phenyl-indol-2-ylidene)-4-phenyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazolidine-3-thione CAS Name: (5Z)-5-(5-bromo-3-phenyl-2-indolylidene)-4-phenyl-2-(1-pyrrolidinylmethyl)-1,2,4-triazolidine-3-thione IUPAC Name: (5Z)-5-(5-bromo-3-phenylindol-2-ylidene)-4-phenyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazolidine-3-thione Traditional Name: (5Z)-5-(5-bromo-3-phenyl-indol-2-ylidene)-4-phenyl-2-(pyrrolidinomethyl)-1,2,4-triazolidine-3-thione Formula: C27H24BrN5S MolecularWeight: 530.48196

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CN2C(=S)N(C(=C3C(=C4C=C(C=CC4=N3)Br)C5=CC=CC=C5)N2)C6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)CN2C(=S)N(/C(=C/3\C(=C4C=C(C=CC4=N3)Br)C5=CC=CC=C5)/N2)C6=CC=CC=C6

InChI

InChI=1S/C27H24BrN5S/c28-20-13-14-23-22(17-20)24(19-9-3-1-4-10-19)25(29-23)26-30-32(18-31-15-7-8-16-31)27(34)33(26)21-11-5-2-6-12-21/h1-6,9-14,17,30H,7-8,15-16,18H2/b26-25+