ethyl 5-phenyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-phenyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-phenyl-2-(tetralin-1-ylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 5-phenyl-2-[[sulfanylidene-(1,2,3,4-tetrahydronaphthalen-1-ylamino)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-phenyl-2-(tetralin-1-ylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C24H24N2O2S2 MolecularWeight: 436.58956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3CCCC4=CC=CC=C34

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3CCCC4=CC=CC=C34

InChI

InChI=1S/C24H24N2O2S2/c1-2-28-23(27)19-15-21(17-10-4-3-5-11-17)30-22(19)26-24(29)25-20-14-8-12-16-9-6-7-13-18(16)20/h3-7,9-11,13,15,20H,2,8,12,14H2,1H3,(H2,25,26,29)