N-[[4-(1,3-benzothiazol-2-yl)phenyl]methylcarbamothioyl]naphthalene-1-carboxamide

Systemtic Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methylcarbamothioyl]naphthalene-1-carboxamide Openeye Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methylcarbamothioyl]naphthalene-1-carboxamide CAS Name: N-[[[4-(1,3-benzothiazol-2-yl)phenyl]methylamino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methylcarbamothioyl]naphthalene-1-carboxamide Traditional Name: N-[[4-(1,3-benzothiazol-2-yl)benzyl]thiocarbamoyl]-1-naphthamide Formula: C26H19N3OS2 MolecularWeight: 453.57856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)NC(=S)NCC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)NC(=S)NCC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H19N3OS2/c30-24(21-9-5-7-18-6-1-2-8-20(18)21)29-26(31)27-16-17-12-14-19(15-13-17)25-28-22-10-3-4-11-23(22)32-25/h1-15H,16H2,(H2,27,29,30,31)