N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide Openeye Name: N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide CAS Name: N-[[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]-4-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide Traditional Name: N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]-4-(2-phenoxyethoxy)benzamide Formula: C30H25N3O3S2 MolecularWeight: 539.6678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(C=C4)OCCOC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(C=C4)OCCOC5=CC=CC=C5

InChI

InChI=1S/C30H25N3O3S2/c1-20-7-16-26-27(19-20)38-29(32-26)22-8-12-23(13-9-22)31-30(37)33-28(34)21-10-14-25(15-11-21)36-18-17-35-24-5-3-2-4-6-24/h2-16,19H,17-18H2,1H3,(H2,31,33,34,37)