1-[4-[(4-phenyl-1,3-thiazol-2-yl)amino]phenyl]sulfonylpyrrolidine-2-carbonitrile

Systemtic Name: 1-[4-[(4-phenyl-1,3-thiazol-2-yl)amino]phenyl]sulfonylpyrrolidine-2-carbonitrile Openeye Name: 1-[4-[(4-phenylthiazol-2-yl)amino]phenyl]sulfonylpyrrolidine-2-carbonitrile CAS Name: 1-[4-[(4-phenyl-2-thiazolyl)amino]phenyl]sulfonyl-2-pyrrolidinecarbonitrile IUPAC Name: 1-[4-[(4-phenyl-1,3-thiazol-2-yl)amino]phenyl]sulfonylpyrrolidine-2-carbonitrile Traditional Name: 1-[4-[(4-phenylthiazol-2-yl)amino]phenyl]sulfonylpyrrolidine-2-carbonitrile Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)NC3=NC(=CS3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)NC3=NC(=CS3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C20H18N4O2S2/c21-13-17-7-4-12-24(17)28(25,26)18-10-8-16(9-11-18)22-20-23-19(14-27-20)15-5-2-1-3-6-15/h1-3,5-6,8-11,14,17H,4,7,12H2,(H,22,23)