N-phenyl-N-(pyridin-3-ylmethyl)-4-(thiiran-2-ylmethylsulfonyl)aniline

Systemtic Name: N-phenyl-N-(pyridin-3-ylmethyl)-4-(thiiran-2-ylmethylsulfonyl)aniline Openeye Name: N-phenyl-N-(3-pyridylmethyl)-4-(thiiran-2-ylmethylsulfonyl)aniline CAS Name: N-phenyl-N-(3-pyridinylmethyl)-4-(2-thiiranylmethylsulfonyl)aniline IUPAC Name: N-phenyl-N-(pyridin-3-ylmethyl)-4-(thiiran-2-ylmethylsulfonyl)aniline Traditional Name: phenyl-(3-pyridylmethyl)-[4-(thiiran-2-ylmethylsulfonyl)phenyl]amine Formula: C21H20N2O2S2 MolecularWeight: 396.5257

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Descriptors Computed from Structure

Canonical SMILES:

C1C(S1)CS(=O)(=O)C2=CC=C(C=C2)N(CC3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(S1)CS(=O)(=O)C2=CC=C(C=C2)N(CC3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O2S2/c24-27(25,16-20-15-26-20)21-10-8-19(9-11-21)23(18-6-2-1-3-7-18)14-17-5-4-12-22-13-17/h1-13,20H,14-16H2