N-[(2-methylquinolin-8-yl)carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[(2-methylquinolin-8-yl)carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[(2-methyl-8-quinolyl)carbamothioyl]benzamide CAS Name: N-[[(2-methyl-8-quinolinyl)amino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[(2-methylquinolin-8-yl)carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[(2-methyl-8-quinolyl)thiocarbamoyl]benzamide Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)C(C)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)C(C)C)C=C1

InChI

InChI=1S/C21H21N3OS/c1-13(2)15-9-11-17(12-10-15)20(25)24-21(26)23-18-6-4-5-16-8-7-14(3)22-19(16)18/h4-13H,1-3H3,(H2,23,24,25,26)