2-(1,3-benzothiazol-2-yl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-(1,3,3-trimethylindolin-2-ylidene)but-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-4-(1,3,3-trimethyl-2-indolylidene)-2-butenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-(1,3,3-trimethylindolin-2-ylidene)but-2-enenitrile Formula: C22H19N3S MolecularWeight: 357.47136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC=C(C#N)C3=NC4=CC=CC=C4S3)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=CC=C(C#N)C3=NC4=CC=CC=C4S3)C)C

InChI

InChI=1S/C22H19N3S/c1-22(2)16-8-4-6-10-18(16)25(3)20(22)13-12-15(14-23)21-24-17-9-5-7-11-19(17)26-21/h4-13H,1-3H3