3-bromanyl-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-ethylbromanuidyl-benzamide

Systemtic Name: 3-bromanyl-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-ethylbromanuidyl-benzamide Openeye Name: 3-bromo-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-ethylbromanuidyl-benzamide CAS Name: 3-bromo-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-ethylbromanuidylbenzamide IUPAC Name: 3-bromo-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-ethylbromanuidylbenzamide Traditional Name: 3-bromo-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-ethylbromanuidyl-benzamide Formula: C19H19Br2N2OS- MolecularWeight: 483.23996

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Descriptors Computed from Structure

Canonical SMILES:

CC[Br-]C1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CC(CC3)C)C#N)Br

Isomeric SMILES

CC[Br-]C1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CC(CC3)C)C#N)Br

InChI

InChI=1S/C19H19Br2N2OS/c1-3-21-16-7-5-12(9-15(16)20)18(24)23-19-14(10-22)13-6-4-11(2)8-17(13)25-19/h5,7,9,11H,3-4,6,8H2,1-2H3,(H,23,24)/q-1