2-azanyl-4-(5-bromanylthiophen-2-yl)-5-ethanoyl-4H-pyrano[3,2-b]indole-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanylthiophen-2-yl)-5-ethanoyl-4H-pyrano[3,2-b]indole-3-carbonitrile Openeye Name: 5-acetyl-2-amino-4-(5-bromo-2-thienyl)-4H-pyrano[3,2-b]indole-3-carbonitrile CAS Name: 5-acetyl-2-amino-4-(5-bromo-2-thiophenyl)-4H-pyrano[3,2-b]indole-3-carbonitrile IUPAC Name: 5-acetyl-2-amino-4-(5-bromothiophen-2-yl)-4H-pyrano[3,2-b]indole-3-carbonitrile Traditional Name: 5-acetyl-2-amino-4-(5-bromo-2-thienyl)-4H-pyran[3,2-b]indole-3-carbonitrile Formula: C18H12BrN3O2S MolecularWeight: 414.27578

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=CC=CC=C2C3=C1C(C(=C(O3)N)C#N)C4=CC=C(S4)Br

Isomeric SMILES

CC(=O)N1C2=CC=CC=C2C3=C1C(C(=C(O3)N)C#N)C4=CC=C(S4)Br

InChI

InChI=1S/C18H12BrN3O2S/c1-9(23)22-12-5-3-2-4-10(12)17-16(22)15(11(8-20)18(21)24-17)13-6-7-14(19)25-13/h2-7,15H,21H2,1H3