2-[(1-butan-2-ylbenzotriazol-5-yl)sulfonyl-methyl-amino]-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide

Systemtic Name: 2-[(1-butan-2-ylbenzotriazol-5-yl)sulfonyl-methyl-amino]-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-[methyl-(1-sec-butylbenzotriazol-5-yl)sulfonyl-amino]acetamide CAS Name: 2-[(1-butan-2-yl-5-benzotriazolyl)sulfonyl-methylamino]-N-[1-(phenylmethyl)-4-piperidinyl]acetamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-[(1-butan-2-ylbenzotriazol-5-yl)sulfonyl-methylamino]acetamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-[methyl-(1-sec-butylbenzotriazol-5-yl)sulfonyl-amino]acetamide Formula: C25H34N6O3S MolecularWeight: 498.64086

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)NC3CCN(CC3)CC4=CC=CC=C4)N=N1

Isomeric SMILES

CCC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)NC3CCN(CC3)CC4=CC=CC=C4)N=N1

InChI

InChI=1S/C25H34N6O3S/c1-4-19(2)31-24-11-10-22(16-23(24)27-28-31)35(33,34)29(3)18-25(32)26-21-12-14-30(15-13-21)17-20-8-6-5-7-9-20/h5-11,16,19,21H,4,12-15,17-18H2,1-3H3,(H,26,32)