N-phenyl-3-(pyridin-3-ylmethyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine

Systemtic Name: N-phenyl-3-(pyridin-3-ylmethyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine Openeye Name: N-phenyl-3-(3-pyridylmethyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-imine CAS Name: N-phenyl-3-(3-pyridinylmethyl)-4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolimine IUPAC Name: N-phenyl-3-(pyridin-3-ylmethyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-imine Traditional Name: phenyl-[3-(3-pyridylmethyl)-4-(4-pyrrolidinosulfonylphenyl)-4-thiazolin-2-ylidene]amine Formula: C25H24N4O2S2 MolecularWeight: 476.61366

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3CC5=CN=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3CC5=CN=CC=C5

InChI

InChI=1S/C25H24N4O2S2/c30-33(31,28-15-4-5-16-28)23-12-10-21(11-13-23)24-19-32-25(27-22-8-2-1-3-9-22)29(24)18-20-7-6-14-26-17-20/h1-3,6-14,17,19H,4-5,15-16,18H2