(4aS)-2-azanyl-4-(4-bromanyl-5-methyl-thiophen-2-yl)-4a,5,6,7-tetrahydronaphthalene-1,3-dicarbonitrile

Systemtic Name: (4aS)-2-azanyl-4-(4-bromanyl-5-methyl-thiophen-2-yl)-4a,5,6,7-tetrahydronaphthalene-1,3-dicarbonitrile Openeye Name: (4aS)-2-amino-4-(4-bromo-5-methyl-2-thienyl)-4a,5,6,7-tetrahydronaphthalene-1,3-dicarbonitrile CAS Name: (4aS)-2-amino-4-(4-bromo-5-methyl-2-thiophenyl)-4a,5,6,7-tetrahydronaphthalene-1,3-dicarbonitrile IUPAC Name: (4aS)-2-amino-4-(4-bromo-5-methylthiophen-2-yl)-4a,5,6,7-tetrahydronaphthalene-1,3-dicarbonitrile Traditional Name: (4aS)-2-amino-4-(4-bromo-5-methyl-2-thienyl)-4a,5,6,7-tetrahydronaphthalene-1,3-dicarbonitrile Formula: C17H14BrN3S MolecularWeight: 372.28216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2=C(C(=C(C3=CCCCC32)C#N)N)C#N)Br

Isomeric SMILES

CC1=C(C=C(S1)C2=C(C(=C(C3=CCCC[C@@H]32)C#N)N)C#N)Br

InChI

InChI=1S/C17H14BrN3S/c1-9-14(18)6-15(22-9)16-11-5-3-2-4-10(11)12(7-19)17(21)13(16)8-20/h4,6,11H,2-3,5,21H2,1H3/t11-/m0/s1