N-[1-[(4-acetamido-3-chloranyl-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[1-[(4-acetamido-3-chloranyl-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide Openeye Name: N-[1-[(4-acetamido-3-chloro-phenyl)carbamoyl]-3-methylsulfanyl-propyl]-3-methyl-benzamide CAS Name: N-[1-(4-acetamido-3-chloroanilino)-4-(methylthio)-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: N-[1-(4-acetamido-3-chloroanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-3-methylbenzamide Traditional Name: N-[1-[(4-acetamido-3-chloro-phenyl)carbamoyl]-3-(methylthio)propyl]-3-methyl-benzamide Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)NC2=CC(=C(C=C2)NC(=O)C)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)NC2=CC(=C(C=C2)NC(=O)C)Cl

InChI

InChI=1S/C21H24ClN3O3S/c1-13-5-4-6-15(11-13)20(27)25-19(9-10-29-3)21(28)24-16-7-8-18(17(22)12-16)23-14(2)26/h4-8,11-12,19H,9-10H2,1-3H3,(H,23,26)(H,24,28)(H,25,27)