4-[5-azanyl-2-bromanyl-4-(phenylcarbonyl)thiophen-3-yl]benzenecarbonitrile

Systemtic Name: 4-[5-azanyl-2-bromanyl-4-(phenylcarbonyl)thiophen-3-yl]benzenecarbonitrile Openeye Name: 4-(5-amino-4-benzoyl-2-bromo-3-thienyl)benzonitrile CAS Name: 4-(5-amino-4-benzoyl-2-bromo-3-thiophenyl)benzonitrile IUPAC Name: 4-(5-amino-4-benzoyl-2-bromothiophen-3-yl)benzonitrile Traditional Name: 4-(5-amino-4-benzoyl-2-bromo-3-thienyl)benzonitrile Formula: C18H11BrN2OS MolecularWeight: 383.26174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(SC(=C2C3=CC=C(C=C3)C#N)Br)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(SC(=C2C3=CC=C(C=C3)C#N)Br)N

InChI

InChI=1S/C18H11BrN2OS/c19-17-14(12-8-6-11(10-20)7-9-12)15(18(21)23-17)16(22)13-4-2-1-3-5-13/h1-9H,21H2