2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-[(1-isopropylbenzotriazol-5-yl)sulfonyl-methyl-amino]-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-[methyl-[(1-propan-2-yl-5-benzotriazolyl)sulfonyl]amino]-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonylamino]-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-[(1-isopropylbenzotriazol-5-yl)sulfonyl-methyl-amino]-N-(3-pyrrolidinopropyl)acetamide Formula: C19H30N6O3S MolecularWeight: 422.5449

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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)NCCCN3CCCC3)N=N1

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)NCCCN3CCCC3)N=N1

InChI

InChI=1S/C19H30N6O3S/c1-15(2)25-18-8-7-16(13-17(18)21-22-25)29(27,28)23(3)14-19(26)20-9-6-12-24-10-4-5-11-24/h7-8,13,15H,4-6,9-12,14H2,1-3H3,(H,20,26)