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

Systemtic Name: 4-azanyl-N5-[(3,4-dimethylphenyl)methyl]-N3-[(4-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(3,4-dimethylphenyl)methyl]-N3-[(4-methoxyphenyl)methyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(3,4-dimethylphenyl)methyl]-N3-[(4-methoxyphenyl)methyl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(3,4-dimethylphenyl)methyl]-3-N-[(4-methoxyphenyl)methyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-(3,4-dimethylbenzyl)-N-p-anisyl-isothiazole-3,5-dicarboxamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)C2=C(C(=NS2)C(=O)NCC3=CC=C(C=C3)OC)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)C2=C(C(=NS2)C(=O)NCC3=CC=C(C=C3)OC)N)C

InChI

InChI=1S/C22H24N4O3S/c1-13-4-5-16(10-14(13)2)12-25-22(28)20-18(23)19(26-30-20)21(27)24-11-15-6-8-17(29-3)9-7-15/h4-10H,11-12,23H2,1-3H3,(H,24,27)(H,25,28)