N-[3-(azepan-1-yl)propyl]-1-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-1-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-1-(1-isopropylbenzotriazol-5-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-1-[(1-propan-2-yl-5-benzotriazolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-1-(1-propan-2-ylbenzotriazol-5-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-1-(1-isopropylbenzotriazol-5-yl)sulfonyl-nipecotamide Formula: C24H38N6O3S MolecularWeight: 490.66192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCCN4CCCCCC4)N=N1

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCCN4CCCCCC4)N=N1

InChI

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