3-chloranyl-N-[[3-[(3-ethoxyphenyl)methoxy]phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[[3-[(3-ethoxyphenyl)methoxy]phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[3-[(3-ethoxyphenyl)methoxy]phenyl]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[3-[(3-ethoxyphenyl)methoxy]anilino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[3-[(3-ethoxyphenyl)methoxy]phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[[3-(3-ethoxybenzyl)oxyphenyl]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C25H21ClN2O3S2 MolecularWeight: 497.02884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)COC2=CC=CC(=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CCOC1=CC=CC(=C1)COC2=CC=CC(=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C25H21ClN2O3S2/c1-2-30-18-9-5-7-16(13-18)15-31-19-10-6-8-17(14-19)27-25(32)28-24(29)23-22(26)20-11-3-4-12-21(20)33-23/h3-14H,2,15H2,1H3,(H2,27,28,29,32)