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

Systemtic Name: 2-[(1-butan-2-ylbenzotriazol-5-yl)sulfonyl-methyl-amino]-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[methyl-(1-sec-butylbenzotriazol-5-yl)sulfonyl-amino]-N-(p-tolylmethyl)acetamide CAS Name: 2-[(1-butan-2-yl-5-benzotriazolyl)sulfonyl-methylamino]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-[(1-butan-2-ylbenzotriazol-5-yl)sulfonyl-methylamino]-N-[(4-methylphenyl)methyl]acetamide Traditional Name: N-(4-methylbenzyl)-2-[methyl-(1-sec-butylbenzotriazol-5-yl)sulfonyl-amino]acetamide Formula: C21H27N5O3S MolecularWeight: 429.53578

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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)NCC3=CC=C(C=C3)C)N=N1

Isomeric SMILES

CCC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)NCC3=CC=C(C=C3)C)N=N1

InChI

InChI=1S/C21H27N5O3S/c1-5-16(3)26-20-11-10-18(12-19(20)23-24-26)30(28,29)25(4)14-21(27)22-13-17-8-6-15(2)7-9-17/h6-12,16H,5,13-14H2,1-4H3,(H,22,27)