N-[2-(azepan-1-yl)ethyl]-2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-amino]ethanamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-amino]ethanamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-2-[(1-isopropylbenzotriazol-5-yl)sulfonyl-methyl-amino]acetamide CAS Name: N-[2-(1-azepanyl)ethyl]-2-[methyl-[(1-propan-2-yl-5-benzotriazolyl)sulfonyl]amino]acetamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonylamino]acetamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-2-[(1-isopropylbenzotriazol-5-yl)sulfonyl-methyl-amino]acetamide Formula: C20H32N6O3S MolecularWeight: 436.57148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)NCCN3CCCCCC3)N=N1

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)NCCN3CCCCCC3)N=N1

InChI

InChI=1S/C20H32N6O3S/c1-16(2)26-19-9-8-17(14-18(19)22-23-26)30(28,29)24(3)15-20(27)21-10-13-25-11-6-4-5-7-12-25/h8-9,14,16H,4-7,10-13,15H2,1-3H3,(H,21,27)