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

Systemtic Name: N-[[3-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]-5-bromanyl-naphthalene-1-carboxamide Openeye Name: N-[[3-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]-5-bromo-naphthalene-1-carboxamide CAS Name: N-[[3-(1,3-benzothiazol-2-yl)-2-methylanilino]-sulfanylidenemethyl]-5-bromo-1-naphthalenecarboxamide IUPAC Name: N-[[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamothioyl]-5-bromonaphthalene-1-carboxamide Traditional Name: N-[[3-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]thiocarbamoyl]-5-bromo-1-naphthamide Formula: C26H18BrN3OS2 MolecularWeight: 532.47462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(C=CC=C1NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H18BrN3OS2/c1-15-16(25-28-22-12-2-3-14-23(22)33-25)7-6-13-21(15)29-26(32)30-24(31)19-10-4-9-18-17(19)8-5-11-20(18)27/h2-14H,1H3,(H2,29,30,31,32)