(2Z)-2-[2-[4-(diphenylamino)phenyl]thiochromen-4-ylidene]-2-isocyano-ethanenitrile

Systemtic Name: (2Z)-2-[2-[4-(diphenylamino)phenyl]thiochromen-4-ylidene]-2-isocyano-ethanenitrile Openeye Name: (2Z)-2-isocyano-2-[2-[4-(N-phenylanilino)phenyl]thiochromen-4-ylidene]acetonitrile CAS Name: (2Z)-2-isocyano-2-[2-[4-(N-phenylanilino)phenyl]-1-benzothiopyran-4-ylidene]acetonitrile IUPAC Name: (2Z)-2-isocyano-2-[2-[4-(N-phenylanilino)phenyl]thiochromen-4-ylidene]acetonitrile Traditional Name: (2Z)-2-isocyano-2-[2-[4-(N-phenylanilino)phenyl]thiochromen-4-ylidene]acetonitrile Formula: C30H19N3S MolecularWeight: 453.55696

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C(=C1C=C(SC2=CC=CC=C21)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

[C-]#[N+]/C(=C\1/C=C(SC2=CC=CC=C21)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5)/C#N

InChI

InChI=1S/C30H19N3S/c1-32-28(21-31)27-20-30(34-29-15-9-8-14-26(27)29)22-16-18-25(19-17-22)33(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h2-20H/b28-27-