4-azanyl-N5-[(2R)-1-(cyclohexylamino)-1-oxidanylidene-butan-2-yl]-N5-(thiophen-2-ylmethyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[(2R)-1-(cyclohexylamino)-1-oxidanylidene-butan-2-yl]-N5-(thiophen-2-ylmethyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[(1R)-1-(cyclohexylcarbamoyl)propyl]-N5-(2-thienylmethyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[(2R)-1-(cyclohexylamino)-1-oxobutan-2-yl]-N5-(thiophen-2-ylmethyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[(2R)-1-(cyclohexylamino)-1-oxobutan-2-yl]-5-N-(thiophen-2-ylmethyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[(1R)-1-(cyclohexylcarbamoyl)propyl]-N'-(2-thenyl)isothiazole-3,5-dicarboxamide Formula: C20H27N5O3S2 MolecularWeight: 449.59008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CCCCC1)N(CC2=CC=CS2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CC[C@H](C(=O)NC1CCCCC1)N(CC2=CC=CS2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C20H27N5O3S2/c1-2-14(19(27)23-12-7-4-3-5-8-12)25(11-13-9-6-10-29-13)20(28)17-15(21)16(18(22)26)24-30-17/h6,9-10,12,14H,2-5,7-8,11,21H2,1H3,(H2,22,26)(H,23,27)/t14-/m1/s1