2-(1-azanylbutyl)-N-[(4-chlorophenyl)-phenyl-methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1-azanylbutyl)-N-[(4-chlorophenyl)-phenyl-methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(1-aminobutyl)-N-[(4-chlorophenyl)-phenyl-methyl]thiazole-4-carboxamide CAS Name: 2-(1-aminobutyl)-N-[(4-chlorophenyl)-phenylmethyl]-4-thiazolecarboxamide IUPAC Name: 2-(1-aminobutyl)-N-[(4-chlorophenyl)-phenylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(1-aminobutyl)-N-[(4-chlorophenyl)-phenyl-methyl]thiazole-4-carboxamide Formula: C21H22ClN3OS MolecularWeight: 399.93688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3OS/c1-2-6-17(23)21-24-18(13-27-21)20(26)25-19(14-7-4-3-5-8-14)15-9-11-16(22)12-10-15/h3-5,7-13,17,19H,2,6,23H2,1H3,(H,25,26)