4-azanyl-N5-(4-methoxyphenyl)-N5-[4-methyl-1-oxidanylidene-1-[(phenylmethyl)amino]pentan-2-yl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(4-methoxyphenyl)-N5-[4-methyl-1-oxidanylidene-1-[(phenylmethyl)amino]pentan-2-yl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[1-(benzylcarbamoyl)-3-methyl-butyl]-N5-(4-methoxyphenyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(4-methoxyphenyl)-N5-[4-methyl-1-oxo-1-[(phenylmethyl)amino]pentan-2-yl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[1-(benzylamino)-4-methyl-1-oxopentan-2-yl]-5-N-(4-methoxyphenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[1-(benzylcarbamoyl)-3-methyl-butyl]-N'-(4-methoxyphenyl)isothiazole-3,5-dicarboxamide Formula: C25H29N5O4S MolecularWeight: 495.59386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N5O4S/c1-15(2)13-19(24(32)28-14-16-7-5-4-6-8-16)30(17-9-11-18(34-3)12-10-17)25(33)22-20(26)21(23(27)31)29-35-22/h4-12,15,19H,13-14,26H2,1-3H3,(H2,27,31)(H,28,32)