N-[4-(4-aminophenyl)carbonylphenyl]-2-(1-azanyl-3-methyl-butyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[4-(4-aminophenyl)carbonylphenyl]-2-(1-azanyl-3-methyl-butyl)-1,3-thiazole-4-carboxamide Openeye Name: N-[4-(4-aminobenzoyl)phenyl]-2-(1-amino-3-methyl-butyl)thiazole-4-carboxamide CAS Name: 2-(1-amino-3-methylbutyl)-N-[4-[(4-aminophenyl)-oxomethyl]phenyl]-4-thiazolecarboxamide IUPAC Name: N-[4-(4-aminobenzoyl)phenyl]-2-(1-amino-3-methylbutyl)-1,3-thiazole-4-carboxamide Traditional Name: N-[4-(4-aminobenzoyl)phenyl]-2-(1-amino-3-methyl-butyl)thiazole-4-carboxamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NC(=CS1)C(=O)NC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)N)N

Isomeric SMILES

CC(C)CC(C1=NC(=CS1)C(=O)NC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)N)N

InChI

InChI=1S/C22H24N4O2S/c1-13(2)11-18(24)22-26-19(12-29-22)21(28)25-17-9-5-15(6-10-17)20(27)14-3-7-16(23)8-4-14/h3-10,12-13,18H,11,23-24H2,1-2H3,(H,25,28)