2-[[(4-tert-butylphenyl)sulfonyl-propan-2-yl-amino]methyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(4-tert-butylphenyl)sulfonyl-propan-2-yl-amino]methyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(4-tert-butylphenyl)sulfonyl-isopropyl-amino]methyl]-N-isopropyl-thiazole-4-carboxamide CAS Name: 2-[[(4-tert-butylphenyl)sulfonyl-propan-2-ylamino]methyl]-N-propan-2-yl-4-thiazolecarboxamide IUPAC Name: 2-[[(4-tert-butylphenyl)sulfonyl-propan-2-ylamino]methyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(4-tert-butylphenyl)sulfonyl-isopropyl-amino]methyl]-N-isopropyl-thiazole-4-carboxamide Formula: C21H31N3O3S2 MolecularWeight: 437.61914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CSC(=N1)CN(C(C)C)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)NC(=O)C1=CSC(=N1)CN(C(C)C)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H31N3O3S2/c1-14(2)22-20(25)18-13-28-19(23-18)12-24(15(3)4)29(26,27)17-10-8-16(9-11-17)21(5,6)7/h8-11,13-15H,12H2,1-7H3,(H,22,25)