N-[2-[1-(1,4-dithiepan-6-yl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide

Systemtic Name: N-[2-[1-(1,4-dithiepan-6-yl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Openeye Name: N-[2-[1-(1,4-dithiepan-6-yl)-4-piperidyl]pyrazol-3-yl]cyclopropanecarboxamide CAS Name: N-[2-[1-(1,4-dithiepan-6-yl)-4-piperidinyl]-3-pyrazolyl]cyclopropanecarboxamide IUPAC Name: N-[2-[1-(1,4-dithiepan-6-yl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Traditional Name: N-[2-[1-(1,4-dithiepan-6-yl)-4-piperidyl]pyrazol-3-yl]cyclopropanecarboxamide Formula: C17H26N4OS2 MolecularWeight: 366.54454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=NN2C3CCN(CC3)C4CSCCSC4

Isomeric SMILES

C1CC1C(=O)NC2=CC=NN2C3CCN(CC3)C4CSCCSC4

InChI

InChI=1S/C17H26N4OS2/c22-17(13-1-2-13)19-16-3-6-18-21(16)14-4-7-20(8-5-14)15-11-23-9-10-24-12-15/h3,6,13-15H,1-2,4-5,7-12H2,(H,19,22)