N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide CAS Name: N-[[(4,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-methoxynaphthalene-2-carboxamide Traditional Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-3-methoxy-2-naphthamide Formula: C22H19N3O4S2 MolecularWeight: 453.53396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)SC(=N2)NC(=S)NC(=O)C3=CC4=CC=CC=C4C=C3OC)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)SC(=N2)NC(=S)NC(=O)C3=CC4=CC=CC=C4C=C3OC)OC

InChI

InChI=1S/C22H19N3O4S2/c1-27-14-10-17(29-3)19-18(11-14)31-22(23-19)25-21(30)24-20(26)15-8-12-6-4-5-7-13(12)9-16(15)28-2/h4-11H,1-3H3,(H2,23,24,25,26,30)