N-[(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: N-[(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide CAS Name: N-[[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-methoxynaphthalene-2-carboxamide Traditional Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-3-methoxy-2-naphthamide Formula: C21H16ClN3O3S2 MolecularWeight: 457.95304

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=NC4=CC(=C(C=C4S3)OC)Cl

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=NC4=CC(=C(C=C4S3)OC)Cl

InChI

InChI=1S/C21H16ClN3O3S2/c1-27-16-8-12-6-4-3-5-11(12)7-13(16)19(26)24-20(29)25-21-23-15-9-14(22)17(28-2)10-18(15)30-21/h3-10H,1-2H3,(H2,23,24,25,26,29)