4-azanyl-N5-[(4-methoxyphenyl)methyl]-N5-[1-oxidanylidene-1-(oxolan-2-ylmethylamino)propan-2-yl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[(4-methoxyphenyl)methyl]-N5-[1-oxidanylidene-1-(oxolan-2-ylmethylamino)propan-2-yl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(4-methoxyphenyl)methyl]-N5-[1-methyl-2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(4-methoxyphenyl)methyl]-N5-[1-oxo-1-(2-oxolanylmethylamino)propan-2-yl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(4-methoxyphenyl)methyl]-5-N-[1-oxo-1-(oxolan-2-ylmethylamino)propan-2-yl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-keto-1-methyl-2-(tetrahydrofurfurylamino)ethyl]-N'-p-anisyl-isothiazole-3,5-dicarboxamide Formula: C21H27N5O5S MolecularWeight: 461.53458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCO1)N(CC2=CC=C(C=C2)OC)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CC(C(=O)NCC1CCCO1)N(CC2=CC=C(C=C2)OC)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C21H27N5O5S/c1-12(20(28)24-10-15-4-3-9-31-15)26(11-13-5-7-14(30-2)8-6-13)21(29)18-16(22)17(19(23)27)25-32-18/h5-8,12,15H,3-4,9-11,22H2,1-2H3,(H2,23,27)(H,24,28)