N-(phenylmethyl)-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine

Systemtic Name: N-(phenylmethyl)-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine Openeye Name: N-benzyl-4-[4-(1-piperidylsulfonyl)phenyl]thiazol-2-amine CAS Name: N-(phenylmethyl)-4-[4-(1-piperidinylsulfonyl)phenyl]-2-thiazolamine IUPAC Name: N-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine Traditional Name: benzyl-[4-(4-piperidinosulfonylphenyl)thiazol-2-yl]amine Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NCC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2S2/c25-28(26,24-13-5-2-6-14-24)19-11-9-18(10-12-19)20-16-27-21(23-20)22-15-17-7-3-1-4-8-17/h1,3-4,7-12,16H,2,5-6,13-15H2,(H,22,23)