N-[1-[(4-aminocarbonylphenyl)methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-chloranyl-benzamide

Systemtic Name: N-[1-[(4-aminocarbonylphenyl)methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-chloranyl-benzamide Openeye Name: N-[1-[(4-carbamoylphenyl)methylcarbamoyl]-3-methylsulfanyl-propyl]-2-chloro-benzamide CAS Name: N-[1-[(4-carbamoylphenyl)methylamino]-4-(methylthio)-1-oxobutan-2-yl]-2-chlorobenzamide IUPAC Name: N-[1-[(4-carbamoylphenyl)methylamino]-4-methylsulfanyl-1-oxobutan-2-yl]-2-chlorobenzamide Traditional Name: N-[1-[(4-carbamoylbenzyl)carbamoyl]-3-(methylthio)propyl]-2-chloro-benzamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC=C(C=C1)C(=O)N)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CSCCC(C(=O)NCC1=CC=C(C=C1)C(=O)N)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C20H22ClN3O3S/c1-28-11-10-17(24-19(26)15-4-2-3-5-16(15)21)20(27)23-12-13-6-8-14(9-7-13)18(22)25/h2-9,17H,10-12H2,1H3,(H2,22,25)(H,23,27)(H,24,26)