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

Systemtic Name: N-[[4-(1,3-benzothiazol-2-yl)-3-chloranyl-phenyl]carbamothioyl]naphthalene-1-carboxamide Openeye Name: N-[[4-(1,3-benzothiazol-2-yl)-3-chloro-phenyl]carbamothioyl]naphthalene-1-carboxamide CAS Name: N-[[4-(1,3-benzothiazol-2-yl)-3-chloroanilino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: N-[[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]carbamothioyl]naphthalene-1-carboxamide Traditional Name: N-[[4-(1,3-benzothiazol-2-yl)-3-chloro-phenyl]thiocarbamoyl]-1-naphthamide Formula: C25H16ClN3OS2 MolecularWeight: 473.99704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)NC(=S)NC3=CC(=C(C=C3)C4=NC5=CC=CC=C5S4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)NC(=S)NC3=CC(=C(C=C3)C4=NC5=CC=CC=C5S4)Cl

InChI

InChI=1S/C25H16ClN3OS2/c26-20-14-16(12-13-19(20)24-28-21-10-3-4-11-22(21)32-24)27-25(31)29-23(30)18-9-5-7-15-6-1-2-8-17(15)18/h1-14H,(H2,27,29,30,31)