4-azanyl-N5-(oxolan-2-ylmethyl)-N3-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(oxolan-2-ylmethyl)-N3-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N3-benzyl-N5-(tetrahydrofuran-2-ylmethyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(2-oxolanylmethyl)-N3-(phenylmethyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-3-N-benzyl-5-N-(oxolan-2-ylmethyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N-benzyl-N'-(tetrahydrofurfuryl)isothiazole-3,5-dicarboxamide Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=C(C(=NS2)C(=O)NCC3=CC=CC=C3)N

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=C(C(=NS2)C(=O)NCC3=CC=CC=C3)N

InChI

InChI=1S/C17H20N4O3S/c18-13-14(16(22)19-9-11-5-2-1-3-6-11)21-25-15(13)17(23)20-10-12-7-4-8-24-12/h1-3,5-6,12H,4,7-10,18H2,(H,19,22)(H,20,23)