2-[(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide

Systemtic Name: 2-[(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Openeye Name: 2-[(5-bromo-2-methoxy-3-methyl-benzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide CAS Name: 2-[[(5-bromo-2-methoxy-3-methylphenyl)-oxomethyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide IUPAC Name: 2-[(5-bromo-2-methoxy-3-methylbenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Traditional Name: 2-[(5-bromo-2-methoxy-3-methyl-benzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N)OC

InChI

InChI=1S/C19H21BrN2O3S/c1-10-8-11(20)9-13(16(10)25-2)18(24)22-19-15(17(21)23)12-6-4-3-5-7-14(12)26-19/h8-9H,3-7H2,1-2H3,(H2,21,23)(H,22,24)