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

Systemtic Name: 2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-amino]-N-(2-pyrrolidin-1-ylethyl)ethanamide Openeye Name: 2-[(1-isopropylbenzotriazol-5-yl)sulfonyl-methyl-amino]-N-(2-pyrrolidin-1-ylethyl)acetamide CAS Name: 2-[methyl-[(1-propan-2-yl-5-benzotriazolyl)sulfonyl]amino]-N-[2-(1-pyrrolidinyl)ethyl]acetamide IUPAC Name: 2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonylamino]-N-(2-pyrrolidin-1-ylethyl)acetamide Traditional Name: 2-[(1-isopropylbenzotriazol-5-yl)sulfonyl-methyl-amino]-N-(2-pyrrolidinoethyl)acetamide Formula: C18H28N6O3S MolecularWeight: 408.51832

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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)NCCN3CCCC3)N=N1

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)NCCN3CCCC3)N=N1

InChI

InChI=1S/C18H28N6O3S/c1-14(2)24-17-7-6-15(12-16(17)20-21-24)28(26,27)22(3)13-18(25)19-8-11-23-9-4-5-10-23/h6-7,12,14H,4-5,8-11,13H2,1-3H3,(H,19,25)