4-azanyl-N5-(1,3-benzodioxol-5-yl)-N5-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(1,3-benzodioxol-5-yl)-N5-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(1,3-benzodioxol-5-yl)-N5-[2-(cyclopentylamino)-2-oxo-ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(1,3-benzodioxol-5-yl)-N5-[2-(cyclopentylamino)-2-oxoethyl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-(1,3-benzodioxol-5-yl)-5-N-[2-(cyclopentylamino)-2-oxoethyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-(1,3-benzodioxol-5-yl)-N'-[2-(cyclopentylamino)-2-keto-ethyl]isothiazole-3,5-dicarboxamide Formula: C19H21N5O5S MolecularWeight: 431.46554

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CN(C2=CC3=C(C=C2)OCO3)C(=O)C4=C(C(=NS4)C(=O)N)N

Isomeric SMILES

C1CCC(C1)NC(=O)CN(C2=CC3=C(C=C2)OCO3)C(=O)C4=C(C(=NS4)C(=O)N)N

InChI

InChI=1S/C19H21N5O5S/c20-15-16(18(21)26)23-30-17(15)19(27)24(8-14(25)22-10-3-1-2-4-10)11-5-6-12-13(7-11)29-9-28-12/h5-7,10H,1-4,8-9,20H2,(H2,21,26)(H,22,25)