N-[[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]carbamothioyl]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: N-[[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]carbamothioyl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: N-[(4,5-dichloro-1,3-benzothiazol-2-yl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide CAS Name: N-[[(4,5-dichloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: N-[(4,5-dichloro-1,3-benzothiazol-2-yl)carbamothioyl]-3-methoxynaphthalene-2-carboxamide Traditional Name: N-[(4,5-dichloro-1,3-benzothiazol-2-yl)thiocarbamoyl]-3-methoxy-2-naphthamide Formula: C20H13Cl2N3O2S2 MolecularWeight: 462.37212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=NC4=C(S3)C=CC(=C4Cl)Cl

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=NC4=C(S3)C=CC(=C4Cl)Cl

InChI

InChI=1S/C20H13Cl2N3O2S2/c1-27-14-9-11-5-3-2-4-10(11)8-12(14)18(26)24-19(28)25-20-23-17-15(29-20)7-6-13(21)16(17)22/h2-9H,1H3,(H2,23,24,25,26,28)