2-azanyl-4-(4-bromanylthiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-bromanylthiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-2-thienyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-2-thiophenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromothiophen-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-2-thienyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile Formula: C16H16BrN3S MolecularWeight: 362.28734

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C(=C(C(=N2)N)C#N)C3=CC(=CS3)Br

Isomeric SMILES

C1CCCC2=C(CC1)C(=C(C(=N2)N)C#N)C3=CC(=CS3)Br

InChI

InChI=1S/C16H16BrN3S/c17-10-7-14(21-9-10)15-11-5-3-1-2-4-6-13(11)20-16(19)12(15)8-18/h7,9H,1-6H2,(H2,19,20)