N-[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-[2-(2-pyridyl)thiazol-4-yl]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-[2-(2-pyridinyl)-4-thiazolyl]ethyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[2-(2-pyridyl)thiazol-4-yl]ethyl]-4-pyrrolidinosulfonyl-benzamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CSC(=N3)C4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CSC(=N3)C4=CC=CC=N4

InChI

InChI=1S/C21H22N4O3S2/c26-20(16-6-8-18(9-7-16)30(27,28)25-13-3-4-14-25)23-12-10-17-15-29-21(24-17)19-5-1-2-11-22-19/h1-2,5-9,11,15H,3-4,10,12-14H2,(H,23,26)