5-methyl-4-(4-methylphenyl)-2-(pentanoylamino)thiophene-3-carboxylate

Systemtic Name: 5-methyl-4-(4-methylphenyl)-2-(pentanoylamino)thiophene-3-carboxylate Openeye Name: 5-methyl-2-(pentanoylamino)-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 5-methyl-4-(4-methylphenyl)-2-(1-oxopentylamino)-3-thiophenecarboxylate IUPAC Name: 5-methyl-4-(4-methylphenyl)-2-(pentanoylamino)thiophene-3-carboxylate Traditional Name: 5-methyl-4-(p-tolyl)-2-(valerylamino)-3-thenoate Formula: C18H20NO3S- MolecularWeight: 330.4213

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=C(S1)C)C2=CC=C(C=C2)C)C(=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=C(C(=C(S1)C)C2=CC=C(C=C2)C)C(=O)[O-]

InChI

InChI=1S/C18H21NO3S/c1-4-5-6-14(20)19-17-16(18(21)22)15(12(3)23-17)13-9-7-11(2)8-10-13/h7-10H,4-6H2,1-3H3,(H,19,20)(H,21,22)/p-1