N-[[3-(cyclopropylcarbonylamino)-2-methyl-phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)-2-methyl-phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: N-[[3-(cyclopropanecarbonylamino)-2-methyl-phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]-2-methylanilino]-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: N-[[3-(cyclopropanecarbonylamino)-2-methylphenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: N-[[3-(cyclopropanecarbonylamino)-2-methyl-phenyl]thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC)NC(=O)C3CC3

Isomeric SMILES

CC1=C(C=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC)NC(=O)C3CC3

InChI

InChI=1S/C22H25N3O4S/c1-14-18(23-20(26)15-6-7-15)4-3-5-19(14)24-22(30)25-21(27)16-8-10-17(11-9-16)29-13-12-28-2/h3-5,8-11,15H,6-7,12-13H2,1-2H3,(H,23,26)(H2,24,25,27,30)