4-tert-butyl-N-[(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(6-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)thiocarbamoyl]benzamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=S)NC(=O)C3=CC=C(C=C3)C(C)(C)C)S2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=S)NC(=O)C3=CC=C(C=C3)C(C)(C)C)S2)C

InChI

InChI=1S/C22H25N3O2S2/c1-6-27-16-11-12-17-18(13-16)29-21(25(17)5)24-20(28)23-19(26)14-7-9-15(10-8-14)22(2,3)4/h7-13H,6H2,1-5H3,(H,23,26,28)