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

Systemtic Name: 4-[[(cyanoamino)-[ethyl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]amino]benzamide Openeye Name: 4-[[(cyanoamino)-[ethyl-(2-thioxo-3H-1,3-benzothiazol-6-yl)amino]methylene]amino]benzamide CAS Name: 4-[[(cyanoamino)-[ethyl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]amino]benzamide IUPAC Name: 4-[[(cyanoamino)-[ethyl-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methylidene]amino]benzamide Traditional Name: 4-[[(cyanoamino)-[ethyl-(2-thioxo-3H-1,3-benzothiazol-6-yl)amino]methylene]amino]benzamide Formula: C18H16N6OS2 MolecularWeight: 396.48924

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)NC(=S)S2)C(=NC3=CC=C(C=C3)C(=O)N)NC#N

Isomeric SMILES

CCN(C1=CC2=C(C=C1)NC(=S)S2)C(=NC3=CC=C(C=C3)C(=O)N)NC#N

InChI

InChI=1S/C18H16N6OS2/c1-2-24(13-7-8-14-15(9-13)27-18(26)23-14)17(21-10-19)22-12-5-3-11(4-6-12)16(20)25/h3-9H,2H2,1H3,(H2,20,25)(H,21,22)(H,23,26)