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

Systemtic Name: carbonic acid; 2-(cyclohexylcarbonylamino)-5-methyl-N-(phenylmethyl)thiophene-3-carboxamide Openeye Name: N-benzyl-2-(cyclohexanecarbonylamino)-5-methyl-thiophene-3-carboxamide; carbonic acid CAS Name: carbonic acid; 2-[[cyclohexyl(oxo)methyl]amino]-5-methyl-N-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: N-benzyl-2-(cyclohexanecarbonylamino)-5-methylthiophene-3-carboxamide; carbonic acid Traditional Name: N-benzyl-2-(cyclohexanecarbonylamino)-5-methyl-thiophene-3-carboxamide; carbonic acid Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2CCCCC2)C(=O)NCC3=CC=CC=C3.C(=O)(O)O

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2CCCCC2)C(=O)NCC3=CC=CC=C3.C(=O)(O)O

InChI

InChI=1S/C20H24N2O2S.CH2O3/c1-14-12-17(19(24)21-13-15-8-4-2-5-9-15)20(25-14)22-18(23)16-10-6-3-7-11-16;2-1(3)4/h2,4-5,8-9,12,16H,3,6-7,10-11,13H2,1H3,(H,21,24)(H,22,23);(H2,2,3,4)