N-[4-[[(2-azanylcyclohexyl)-ethanoyl-amino]methyl]phenyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: N-[4-[[(2-azanylcyclohexyl)-ethanoyl-amino]methyl]phenyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-[4-[[acetyl-(2-aminocyclohexyl)amino]methyl]phenyl]-4-methyl-thiadiazole-5-carboxamide CAS Name: N-[4-[[acetyl-(2-aminocyclohexyl)amino]methyl]phenyl]-4-methyl-5-thiadiazolecarboxamide IUPAC Name: N-[4-[[acetyl-(2-aminocyclohexyl)amino]methyl]phenyl]-4-methylthiadiazole-5-carboxamide Traditional Name: N-[4-[[acetyl-(2-aminocyclohexyl)amino]methyl]phenyl]-4-methyl-thiadiazole-5-carboxamide Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)NC2=CC=C(C=C2)CN(C3CCCCC3N)C(=O)C

Isomeric SMILES

CC1=C(SN=N1)C(=O)NC2=CC=C(C=C2)CN(C3CCCCC3N)C(=O)C

InChI

InChI=1S/C19H25N5O2S/c1-12-18(27-23-22-12)19(26)21-15-9-7-14(8-10-15)11-24(13(2)25)17-6-4-3-5-16(17)20/h7-10,16-17H,3-6,11,20H2,1-2H3,(H,21,26)