N-[3-(azepan-1-yl)propyl]-1-(1-propylbenzotriazol-5-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-1-(1-propylbenzotriazol-5-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-1-(1-propylbenzotriazol-5-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-1-[(1-propyl-5-benzotriazolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-1-(1-propylbenzotriazol-5-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-1-(1-propylbenzotriazol-5-yl)sulfonyl-nipecotamide Formula: C24H38N6O3S MolecularWeight: 490.66192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCCN4CCCCCC4)N=N1

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCCN4CCCCCC4)N=N1

InChI

InChI=1S/C24H38N6O3S/c1-2-13-30-23-11-10-21(18-22(23)26-27-30)34(32,33)29-17-7-9-20(19-29)24(31)25-12-8-16-28-14-5-3-4-6-15-28/h10-11,18,20H,2-9,12-17,19H2,1H3,(H,25,31)