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

Systemtic Name: 4-azanyl-N5-[1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl]-N5-(4-propan-2-ylphenyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[1-(benzylcarbamoyl)propyl]-N5-(4-isopropylphenyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[1-oxo-1-[(phenylmethyl)amino]butan-2-yl]-N5-(4-propan-2-ylphenyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[1-(benzylamino)-1-oxobutan-2-yl]-5-N-(4-propan-2-ylphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[1-(benzylcarbamoyl)propyl]-N'-p-cumenyl-isothiazole-3,5-dicarboxamide Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)N(C2=CC=C(C=C2)C(C)C)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)N(C2=CC=C(C=C2)C(C)C)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C25H29N5O3S/c1-4-19(24(32)28-14-16-8-6-5-7-9-16)30(18-12-10-17(11-13-18)15(2)3)25(33)22-20(26)21(23(27)31)29-34-22/h5-13,15,19H,4,14,26H2,1-3H3,(H2,27,31)(H,28,32)