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

Systemtic Name: 4-tert-butyl-N-[(2-methyl-1,3-benzothiazol-6-yl)carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[(2-methyl-1,3-benzothiazol-6-yl)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[(2-methyl-1,3-benzothiazol-6-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(2-methyl-1,3-benzothiazol-6-yl)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(2-methyl-1,3-benzothiazol-6-yl)thiocarbamoyl]benzamide Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C20H21N3OS2/c1-12-21-16-10-9-15(11-17(16)26-12)22-19(25)23-18(24)13-5-7-14(8-6-13)20(2,3)4/h5-11H,1-4H3,(H2,22,23,24,25)