N-butyl-4-[[(cyanoamino)-[ethyl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]amino]benzamide

Systemtic Name: N-butyl-4-[[(cyanoamino)-[ethyl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]amino]benzamide Openeye Name: N-butyl-4-[[(cyanoamino)-[ethyl-(2-thioxo-3H-1,3-benzothiazol-6-yl)amino]methylene]amino]benzamide CAS Name: N-butyl-4-[[(cyanoamino)-[ethyl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]amino]benzamide IUPAC Name: N-butyl-4-[[(cyanoamino)-[ethyl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]amino]benzamide Traditional Name: N-butyl-4-[[(cyanoamino)-[ethyl-(2-thioxo-3H-1,3-benzothiazol-6-yl)amino]methylene]amino]benzamide Formula: C22H24N6OS2 MolecularWeight: 452.59556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)N=C(NC#N)N(CC)C2=CC3=C(C=C2)NC(=S)S3

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)N=C(NC#N)N(CC)C2=CC3=C(C=C2)NC(=S)S3

InChI

InChI=1S/C22H24N6OS2/c1-3-5-12-24-20(29)15-6-8-16(9-7-15)26-21(25-14-23)28(4-2)17-10-11-18-19(13-17)31-22(30)27-18/h6-11,13H,3-5,12H2,1-2H3,(H,24,29)(H,25,26)(H,27,30)