2-[4-[(Z)-2-cyano-2-isocyano-1-phenyl-ethenyl]sulfinamoyloxyphenyl]imino-3-(2-sulfanylethyl)-1,3-benzothiazole

Systemtic Name: 2-[4-[(Z)-2-cyano-2-isocyano-1-phenyl-ethenyl]sulfinamoyloxyphenyl]imino-3-(2-sulfanylethyl)-1,3-benzothiazole Openeye Name: 2-[4-[(Z)-2-cyano-2-isocyano-1-phenyl-vinyl]sulfinamoyloxyphenyl]imino-3-(2-sulfanylethyl)-1,3-benzothiazole CAS Name: 2-[4-[(Z)-2-cyano-2-isocyano-1-phenylethenyl]sulfinamoyloxyphenyl]imino-3-(2-mercaptoethyl)-1,3-benzothiazole IUPAC Name: 2-[4-[(Z)-2-cyano-2-isocyano-1-phenylethenyl]sulfinamoyloxyphenyl]imino-3-(2-sulfanylethyl)-1,3-benzothiazole Traditional Name: 2-[4-[(Z)-2-cyano-2-isocyano-1-phenyl-vinyl]sulfinamoyloxyphenyl]imino-3-(2-mercaptoethyl)-1,3-benzothiazole Formula: C25H19N5O2S3 MolecularWeight: 517.64566

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C(=C(C1=CC=CC=C1)NS(=O)OC2=CC=C(C=C2)N=C3N(C4=CC=CC=C4S3)CCS)C#N

Isomeric SMILES

[C-]#[N+]/C(=C(/C1=CC=CC=C1)\NS(=O)OC2=CC=C(C=C2)N=C3N(C4=CC=CC=C4S3)CCS)/C#N

InChI

InChI=1S/C25H19N5O2S3/c1-27-21(17-26)24(18-7-3-2-4-8-18)29-35(31)32-20-13-11-19(12-14-20)28-25-30(15-16-33)22-9-5-6-10-23(22)34-25/h2-14,29,33H,15-16H2/b24-21-,28-25?