N-(3-methylbutyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine

Systemtic Name: N-(3-methylbutyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine Openeye Name: N-isopentyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-amine CAS Name: N-(3-methylbutyl)-4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolamine IUPAC Name: N-(3-methylbutyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine Traditional Name: isoamyl-[4-(4-pyrrolidinosulfonylphenyl)thiazol-2-yl]amine Formula: C18H25N3O2S2 MolecularWeight: 379.54

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=CS1)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)CCNC1=NC(=CS1)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H25N3O2S2/c1-14(2)9-10-19-18-20-17(13-24-18)15-5-7-16(8-6-15)25(22,23)21-11-3-4-12-21/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,19,20)