ethyl 2-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylcarbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylcarbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-bromo-3-methoxy-naphthalene-2-carbonyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[[(4-bromo-3-methoxy-2-naphthalenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-bromo-3-methoxynaphthalene-2-carbonyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[(4-bromo-3-methoxy-2-naphthoyl)thiocarbamoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C23H21BrN2O4S2 MolecularWeight: 533.45784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC2)NC(=S)NC(=O)C3=CC4=CC=CC=C4C(=C3OC)Br

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC2)NC(=S)NC(=O)C3=CC4=CC=CC=C4C(=C3OC)Br

InChI

InChI=1S/C23H21BrN2O4S2/c1-3-30-22(28)17-14-9-6-10-16(14)32-21(17)26-23(31)25-20(27)15-11-12-7-4-5-8-13(12)18(24)19(15)29-2/h4-5,7-8,11H,3,6,9-10H2,1-2H3,(H2,25,26,27,31)