[4-(phenylmethyl)piperidin-1-yl]-(4-pyrrolidin-1-ylsulfonylthiophen-2-yl)methanone

Systemtic Name: [4-(phenylmethyl)piperidin-1-yl]-(4-pyrrolidin-1-ylsulfonylthiophen-2-yl)methanone Openeye Name: (4-benzyl-1-piperidyl)-(4-pyrrolidin-1-ylsulfonyl-2-thienyl)methanone CAS Name: [4-(phenylmethyl)-1-piperidinyl]-[4-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-(4-pyrrolidin-1-ylsulfonylthiophen-2-yl)methanone Traditional Name: (4-benzylpiperidino)-(4-pyrrolidinosulfonyl-2-thienyl)methanone Formula: C21H26N2O3S2 MolecularWeight: 418.57274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H26N2O3S2/c24-21(20-15-19(16-27-20)28(25,26)23-10-4-5-11-23)22-12-8-18(9-13-22)14-17-6-2-1-3-7-17/h1-3,6-7,15-16,18H,4-5,8-14H2