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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=C(C(=NS1)C(=O)NCC2=CC(=CC=C2)OC)N)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)C1=C(C(=NS1)C(=O)NCC2=CC(=CC=C2)OC)N)C3=CC=CC=C3

InChI

InChI=1S/C22H24N4O3S/c1-14(16-8-4-3-5-9-16)12-24-22(28)20-18(23)19(26-30-20)21(27)25-13-15-7-6-10-17(11-15)29-2/h3-11,14H,12-13,23H2,1-2H3,(H,24,28)(H,25,27)