N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)isonipecotamide Formula: C24H30N6OS MolecularWeight: 450.5996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCN2CCC3=CC=CC=C3C2)C4=NN=C(S4)N5C=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NCCCN2CCC3=CC=CC=C3C2)C4=NN=C(S4)N5C=CC=C5

InChI

InChI=1S/C24H30N6OS/c31-22(25-11-5-12-28-15-8-19-6-1-2-7-21(19)18-28)20-9-16-30(17-10-20)24-27-26-23(32-24)29-13-3-4-14-29/h1-4,6-7,13-14,20H,5,8-12,15-18H2,(H,25,31)