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

Systemtic Name: ethyl 1-(phenylcarbonylcarbamothioylamino)spiro[4H-naphthalene-3,1'-cyclopentane]-2-carboxylate Openeye Name: ethyl 1-(benzoylcarbamothioylamino)spiro[4H-naphthalene-3,1'-cyclopentane]-2-carboxylate CAS Name: 1-[[benzamido(sulfanylidene)methyl]amino]-2-spiro[4H-naphthalene-3,1'-cyclopentane]carboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzoylcarbamothioylamino)spiro[4H-naphthalene-3,1'-cyclopentane]-2-carboxylate Traditional Name: 1-(benzoylthiocarbamoylamino)spiro[4H-naphthalene-3,1'-cyclopentane]-2-carboxylic acid ethyl ester Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2CC13CCCC3)NC(=S)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2CC13CCCC3)NC(=S)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O3S/c1-2-30-23(29)20-21(26-24(31)27-22(28)17-10-4-3-5-11-17)19-13-7-6-12-18(19)16-25(20)14-8-9-15-25/h3-7,10-13H,2,8-9,14-16H2,1H3,(H2,26,27,28,31)