2-[(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile

Systemtic Name: 2-[(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile Openeye Name: 2-[(3-bromo-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile CAS Name: 2-[(3-bromo-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile IUPAC Name: 2-[(3-bromo-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile Traditional Name: 2-[(3-bromo-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile Formula: C16H13BrN4O3S MolecularWeight: 421.26842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)SC(=C2C#N)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Br

Isomeric SMILES

CN1CCC2=C(C1)SC(=C2C#N)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Br

InChI

InChI=1S/C16H13BrN4O3S/c1-20-3-2-11-12(6-18)16(25-14(11)8-20)19-7-9-4-10(17)5-13(15(9)22)21(23)24/h4-5,7,19H,2-3,8H2,1H3