N-[5-[(2-azanylcyclohexyl)carbamoyl]-2-(thiomorpholin-4-ylmethyl)phenyl]thiophene-2-carboxamide

Systemtic Name: N-[5-[(2-azanylcyclohexyl)carbamoyl]-2-(thiomorpholin-4-ylmethyl)phenyl]thiophene-2-carboxamide Openeye Name: N-[5-[(2-aminocyclohexyl)carbamoyl]-2-(thiomorpholinomethyl)phenyl]thiophene-2-carboxamide CAS Name: N-[5-[[(2-aminocyclohexyl)amino]-oxomethyl]-2-(thiomorpholin-4-ylmethyl)phenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-[(2-aminocyclohexyl)carbamoyl]-2-(thiomorpholin-4-ylmethyl)phenyl]thiophene-2-carboxamide Traditional Name: N-[5-[(2-aminocyclohexyl)carbamoyl]-2-(thiomorpholinomethyl)phenyl]thiophene-2-carboxamide Formula: C23H30N4O2S2 MolecularWeight: 458.6399

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)NC(=O)C2=CC(=C(C=C2)CN3CCSCC3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CCC(C(C1)N)NC(=O)C2=CC(=C(C=C2)CN3CCSCC3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H30N4O2S2/c24-18-4-1-2-5-19(18)25-22(28)16-7-8-17(15-27-9-12-30-13-10-27)20(14-16)26-23(29)21-6-3-11-31-21/h3,6-8,11,14,18-19H,1-2,4-5,9-10,12-13,15,24H2,(H,25,28)(H,26,29)