(4-bromophenyl)-(3-phenylazanyl-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)methanone

Systemtic Name: (4-bromophenyl)-(3-phenylazanyl-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)methanone Openeye Name: (3-anilino-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)-(4-bromophenyl)methanone CAS Name: (3-anilino-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)-(4-bromophenyl)methanone IUPAC Name: (3-anilino-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)-(4-bromophenyl)methanone Traditional Name: (3-anilino-4,5,6,7-tetrahydroisobenzothiophen-1-yl)-(4-bromophenyl)methanone Formula: C21H18BrNOS MolecularWeight: 412.34272

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(SC(=C2C1)C(=O)C3=CC=C(C=C3)Br)NC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(SC(=C2C1)C(=O)C3=CC=C(C=C3)Br)NC4=CC=CC=C4

InChI

InChI=1S/C21H18BrNOS/c22-15-12-10-14(11-13-15)19(24)20-17-8-4-5-9-18(17)21(25-20)23-16-6-2-1-3-7-16/h1-3,6-7,10-13,23H,4-5,8-9H2