carbonic acid; 2-(cyclohexylcarbonylamino)-5-ethyl-N-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: carbonic acid; 2-(cyclohexylcarbonylamino)-5-ethyl-N-(phenylmethyl)thiophene-3-carboxamide Openeye Name: N-benzyl-2-(cyclohexanecarbonylamino)-5-ethyl-thiophene-3-carboxamide; carbonic acid CAS Name: carbonic acid; 2-[[cyclohexyl(oxo)methyl]amino]-5-ethyl-N-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: N-benzyl-2-(cyclohexanecarbonylamino)-5-ethylthiophene-3-carboxamide; carbonic acid Traditional Name: N-benzyl-2-(cyclohexanecarbonylamino)-5-ethyl-thiophene-3-carboxamide; carbonic acid Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2CCCCC2)C(=O)NCC3=CC=CC=C3.C(=O)(O)O

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2CCCCC2)C(=O)NCC3=CC=CC=C3.C(=O)(O)O

InChI

InChI=1S/C21H26N2O2S.CH2O3/c1-2-17-13-18(20(25)22-14-15-9-5-3-6-10-15)21(26-17)23-19(24)16-11-7-4-8-12-16;2-1(3)4/h3,5-6,9-10,13,16H,2,4,7-8,11-12,14H2,1H3,(H,22,25)(H,23,24);(H2,2,3,4)