4-azanyl-N5-[2-(4-chlorophenyl)ethyl]-N3-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[2-(4-chlorophenyl)ethyl]-N3-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N3-benzyl-N5-[2-(4-chlorophenyl)ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(4-chlorophenyl)ethyl]-N3-(phenylmethyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-3-N-benzyl-5-N-[2-(4-chlorophenyl)ethyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N-benzyl-N'-[2-(4-chlorophenyl)ethyl]isothiazole-3,5-dicarboxamide Formula: C20H19ClN4O2S MolecularWeight: 414.90846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=NSC(=C2N)C(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=NSC(=C2N)C(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN4O2S/c21-15-8-6-13(7-9-15)10-11-23-20(27)18-16(22)17(25-28-18)19(26)24-12-14-4-2-1-3-5-14/h1-9H,10-12,22H2,(H,23,27)(H,24,26)