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

Systemtic Name: 2-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Openeye Name: 2-[(4-bromo-3-methoxy-naphthalene-2-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide CAS Name: 2-[[(4-bromo-3-methoxy-2-naphthalenyl)-oxomethyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide IUPAC Name: 2-[(4-bromo-3-methoxynaphthalene-2-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Traditional Name: 2-[(4-bromo-3-methoxy-2-naphthoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Formula: C22H21BrN2O3S MolecularWeight: 473.38274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1C(=O)NC3=C(C4=C(S3)CCCCC4)C(=O)N)Br

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1C(=O)NC3=C(C4=C(S3)CCCCC4)C(=O)N)Br

InChI

InChI=1S/C22H21BrN2O3S/c1-28-19-15(11-12-7-5-6-8-13(12)18(19)23)21(27)25-22-17(20(24)26)14-9-3-2-4-10-16(14)29-22/h5-8,11H,2-4,9-10H2,1H3,(H2,24,26)(H,25,27)