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

Systemtic Name: 4-azanyl-N5-[1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl]-N5-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-benzyl-N5-[2-(cyclopentylamino)-1-methyl-2-oxo-ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[1-(cyclopentylamino)-1-oxopropan-2-yl]-N5-(phenylmethyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-benzyl-5-N-[1-(cyclopentylamino)-1-oxopropan-2-yl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-benzyl-N'-[2-(cyclopentylamino)-2-keto-1-methyl-ethyl]isothiazole-3,5-dicarboxamide Formula: C20H25N5O3S MolecularWeight: 415.5092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)N(CC2=CC=CC=C2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CC(C(=O)NC1CCCC1)N(CC2=CC=CC=C2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C20H25N5O3S/c1-12(19(27)23-14-9-5-6-10-14)25(11-13-7-3-2-4-8-13)20(28)17-15(21)16(18(22)26)24-29-17/h2-4,7-8,12,14H,5-6,9-11,21H2,1H3,(H2,22,26)(H,23,27)