1-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-N-[(4-propan-2-yloxyphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-N-[(4-propan-2-yloxyphenyl)methyl]piperidine-3-carboxamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-1-(1-isopropylbenzotriazol-5-yl)sulfonyl-piperidine-3-carboxamide CAS Name: 1-[(1-propan-2-yl-5-benzotriazolyl)sulfonyl]-N-[(4-propan-2-yloxyphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-N-[(4-propan-2-yloxyphenyl)methyl]piperidine-3-carboxamide Traditional Name: N-(4-isopropoxybenzyl)-1-(1-isopropylbenzotriazol-5-yl)sulfonyl-nipecotamide Formula: C25H33N5O4S MolecularWeight: 499.62562

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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)NCC4=CC=C(C=C4)OC(C)C)N=N1

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCC4=CC=C(C=C4)OC(C)C)N=N1

InChI

InChI=1S/C25H33N5O4S/c1-17(2)30-24-12-11-22(14-23(24)27-28-30)35(32,33)29-13-5-6-20(16-29)25(31)26-15-19-7-9-21(10-8-19)34-18(3)4/h7-12,14,17-18,20H,5-6,13,15-16H2,1-4H3,(H,26,31)