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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O3S2/c26-20(16-3-5-19(6-4-16)30(27,28)25-13-1-2-14-25)23-12-9-18-15-29-21(24-18)17-7-10-22-11-8-17/h3-8,10-11,15H,1-2,9,12-14H2,(H,23,26)