ethyl 2-[(Z)-(3-aminocarbonyl-6-bromanyl-chromen-2-ylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(Z)-(3-aminocarbonyl-6-bromanyl-chromen-2-ylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(Z)-(6-bromo-3-carbamoyl-chromen-2-ylidene)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[(Z)-(6-bromo-3-carbamoyl-1-benzopyran-2-ylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(Z)-(6-bromo-3-carbamoylchromen-2-ylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[(Z)-(6-bromo-3-carbamoyl-chromen-2-ylidene)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C21H19BrN2O4S MolecularWeight: 475.35556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)N=C3C(=CC4=C(O3)C=CC(=C4)Br)C(=O)N

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)/N=C\3/C(=CC4=C(O3)C=CC(=C4)Br)C(=O)N

InChI

InChI=1S/C21H19BrN2O4S/c1-2-27-21(26)17-13-5-3-4-6-16(13)29-20(17)24-19-14(18(23)25)10-11-9-12(22)7-8-15(11)28-19/h7-10H,2-6H2,1H3,(H2,23,25)/b24-19-