4-azanyl-N3-[(4-methylphenyl)methyl]-N5-(2-phenylpropyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N3-[(4-methylphenyl)methyl]-N5-(2-phenylpropyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(2-phenylpropyl)-N3-(p-tolylmethyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N3-[(4-methylphenyl)methyl]-N5-(2-phenylpropyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-3-N-[(4-methylphenyl)methyl]-5-N-(2-phenylpropyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N-(4-methylbenzyl)-N'-(2-phenylpropyl)isothiazole-3,5-dicarboxamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=NSC(=C2N)C(=O)NCC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=NSC(=C2N)C(=O)NCC(C)C3=CC=CC=C3

InChI

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