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

Systemtic Name: 4-azanyl-N5-[2-(3,4-diethoxyphenyl)ethyl]-N3-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N3-benzyl-N5-[2-(3,4-diethoxyphenyl)ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(3,4-diethoxyphenyl)ethyl]-N3-(phenylmethyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-3-N-benzyl-5-N-[2-(3,4-diethoxyphenyl)ethyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N-benzyl-N'-[2-(3,4-diethoxyphenyl)ethyl]isothiazole-3,5-dicarboxamide Formula: C24H28N4O4S MolecularWeight: 468.56852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=C(C(=NS2)C(=O)NCC3=CC=CC=C3)N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=C(C(=NS2)C(=O)NCC3=CC=CC=C3)N)OCC

InChI

InChI=1S/C24H28N4O4S/c1-3-31-18-11-10-16(14-19(18)32-4-2)12-13-26-24(30)22-20(25)21(28-33-22)23(29)27-15-17-8-6-5-7-9-17/h5-11,14H,3-4,12-13,15,25H2,1-2H3,(H,26,30)(H,27,29)