2-[(5Z)-5-[2-(1-hexadecylpyridin-4-ylidene)ethylidene]thiophen-2-ylidene]propanedinitrile

Systemtic Name: 2-[(5Z)-5-[2-(1-hexadecylpyridin-4-ylidene)ethylidene]thiophen-2-ylidene]propanedinitrile Openeye Name: 2-[(5Z)-5-[2-(1-hexadecyl-4-pyridylidene)ethylidene]-2-thienylidene]propanedinitrile CAS Name: 2-[(5Z)-5-[2-(1-hexadecyl-4-pyridinylidene)ethylidene]-2-thiophenylidene]propanedinitrile IUPAC Name: 2-[(5Z)-5-[2-(1-hexadecylpyridin-4-ylidene)ethylidene]thiophen-2-ylidene]propanedinitrile Traditional Name: 2-[(5Z)-5-[2-(1-cetyl-4-pyridylidene)ethylidene]-2-thienylidene]malononitrile Formula: C30H41N3S MolecularWeight: 475.73164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C=CC(=CC=C2C=CC(=C(C#N)C#N)S2)C=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C=CC(=C/C=C\2/C=CC(=C(C#N)C#N)S2)C=C1

InChI

InChI=1S/C30H41N3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-33-23-20-27(21-24-33)16-17-29-18-19-30(34-29)28(25-31)26-32/h16-21,23-24H,2-15,22H2,1H3/b29-17-