4-azanyl-N5-(3-methylphenyl)-N5-[1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(3-methylphenyl)-N5-[1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(benzylamino)-1-methyl-2-oxo-ethyl]-N5-(m-tolyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(3-methylphenyl)-N5-[1-oxo-1-[(phenylmethyl)amino]propan-2-yl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[1-(benzylamino)-1-oxopropan-2-yl]-5-N-(3-methylphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(benzylamino)-2-keto-1-methyl-ethyl]-N'-(m-tolyl)isothiazole-3,5-dicarboxamide Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C(C)C(=O)NCC2=CC=CC=C2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CC1=CC(=CC=C1)N(C(C)C(=O)NCC2=CC=CC=C2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C22H23N5O3S/c1-13-7-6-10-16(11-13)27(22(30)19-17(23)18(20(24)28)26-31-19)14(2)21(29)25-12-15-8-4-3-5-9-15/h3-11,14H,12,23H2,1-2H3,(H2,24,28)(H,25,29)