2-(cyclohexylcarbamoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Systemtic Name: 2-(cyclohexylcarbamoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Openeye Name: 2-(cyclohexylcarbamoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid CAS Name: 2-[[(cyclohexylamino)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid IUPAC Name: 2-(cyclohexylcarbamoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Traditional Name: 2-(cyclohexylcarbamoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)O

InChI

InChI=1S/C16H22N2O3S/c19-15(20)13-11-8-4-5-9-12(11)22-14(13)18-16(21)17-10-6-2-1-3-7-10/h10H,1-9H2,(H,19,20)(H2,17,18,21)