N-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: N-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]naphthalene-1-carboxamide Openeye Name: N-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]naphthalene-1-carboxamide CAS Name: N-[[5-(1,3-benzothiazol-2-yl)-2-methylanilino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: N-[[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamothioyl]naphthalene-1-carboxamide Traditional Name: N-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]thiocarbamoyl]-1-naphthamide Formula: C26H19N3OS2 MolecularWeight: 453.57856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=S)NC(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=S)NC(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H19N3OS2/c1-16-13-14-18(25-27-21-11-4-5-12-23(21)32-25)15-22(16)28-26(31)29-24(30)20-10-6-8-17-7-2-3-9-19(17)20/h2-15H,1H3,(H2,28,29,30,31)