N-[[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-(diethylamino)benzamide

Systemtic Name: N-[[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-(diethylamino)benzamide Openeye Name: N-[[4-(4-tert-butylphenyl)thiazol-2-yl]carbamothioyl]-4-(diethylamino)benzamide CAS Name: N-[[[4-(4-tert-butylphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-4-(diethylamino)benzamide IUPAC Name: N-[[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-(diethylamino)benzamide Traditional Name: N-[[4-(4-tert-butylphenyl)thiazol-2-yl]thiocarbamoyl]-4-(diethylamino)benzamide Formula: C25H30N4OS2 MolecularWeight: 466.6619

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C25H30N4OS2/c1-6-29(7-2)20-14-10-18(11-15-20)22(30)27-23(31)28-24-26-21(16-32-24)17-8-12-19(13-9-17)25(3,4)5/h8-16H,6-7H2,1-5H3,(H2,26,27,28,30,31)