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

Systemtic Name: 4-tert-butyl-N-[(Z)-(4-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[(Z)-(4-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[(Z)-(4-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(Z)-(4-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(Z)-(4-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)thiocarbamoyl]benzamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)N=C2N(C3=C(C=CC=C3S2)OC)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)/N=C\2/N(C3=C(C=CC=C3S2)OC)C

InChI

InChI=1S/C21H23N3O2S2/c1-21(2,3)14-11-9-13(10-12-14)18(25)22-19(27)23-20-24(4)17-15(26-5)7-6-8-16(17)28-20/h6-12H,1-5H3,(H,22,25,27)/b23-20-