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

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)-2-methyl-phenyl]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[3-(cyclopropanecarbonylamino)-2-methyl-phenyl]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]-2-methylanilino]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[3-(cyclopropanecarbonylamino)-2-methylphenyl]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[[3-(cyclopropanecarbonylamino)-2-methyl-phenyl]thiocarbamoyl]benzamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2C)NC(=O)C3CC3

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2C)NC(=O)C3CC3

InChI

InChI=1S/C24H29N3O3S/c1-3-4-7-15-30-21-12-6-5-9-18(21)23(29)27-24(31)26-20-11-8-10-19(16(20)2)25-22(28)17-13-14-17/h5-6,8-12,17H,3-4,7,13-15H2,1-2H3,(H,25,28)(H2,26,27,29,31)