2-[[4-(4-cyanobutan-2-ylamino)phenyl]diazenyl]-5-phenyldiazenyl-thiophene-3-carbonitrile

Systemtic Name: 2-[[4-(4-cyanobutan-2-ylamino)phenyl]diazenyl]-5-phenyldiazenyl-thiophene-3-carbonitrile Openeye Name: 2-[4-[(3-cyano-1-methyl-propyl)amino]phenyl]azo-5-phenylazo-thiophene-3-carbonitrile CAS Name: 2-[4-(4-cyanobutan-2-ylamino)phenyl]azo-5-phenyldiazenyl-3-thiophenecarbonitrile IUPAC Name: 2-[[4-(4-cyanobutan-2-ylamino)phenyl]diazenyl]-5-phenyldiazenylthiophene-3-carbonitrile Traditional Name: 2-[4-[(3-cyano-1-methyl-propyl)amino]phenyl]azo-5-phenylazo-thiophene-3-carbonitrile Formula: C22H19N7S MolecularWeight: 413.49816

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC#N)NC1=CC=C(C=C1)N=NC2=C(C=C(S2)N=NC3=CC=CC=C3)C#N

Isomeric SMILES

CC(CCC#N)NC1=CC=C(C=C1)N=NC2=C(C=C(S2)N=NC3=CC=CC=C3)C#N

InChI

InChI=1S/C22H19N7S/c1-16(6-5-13-23)25-18-9-11-20(12-10-18)27-29-22-17(15-24)14-21(30-22)28-26-19-7-3-2-4-8-19/h2-4,7-12,14,16,25H,5-6H2,1H3