ethyl 1-(phenylcarbonylcarbamothioylamino)spiro[4H-naphthalene-3,1'-cyclohexane]-2-carboxylate

Systemtic Name: ethyl 1-(phenylcarbonylcarbamothioylamino)spiro[4H-naphthalene-3,1'-cyclohexane]-2-carboxylate Openeye Name: ethyl 1-(benzoylcarbamothioylamino)spiro[4H-naphthalene-3,1'-cyclohexane]-2-carboxylate CAS Name: 1-[[benzamido(sulfanylidene)methyl]amino]-2-spiro[4H-naphthalene-3,1'-cyclohexane]carboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzoylcarbamothioylamino)spiro[4H-naphthalene-3,1'-cyclohexane]-2-carboxylate Traditional Name: 1-(benzoylthiocarbamoylamino)spiro[4H-naphthalene-3,1'-cyclohexane]-2-carboxylic acid ethyl ester Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2CC13CCCCC3)NC(=S)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2CC13CCCCC3)NC(=S)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H28N2O3S/c1-2-31-24(30)21-22(27-25(32)28-23(29)18-11-5-3-6-12-18)20-14-8-7-13-19(20)17-26(21)15-9-4-10-16-26/h3,5-8,11-14H,2,4,9-10,15-17H2,1H3,(H2,27,28,29,32)