3-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 3-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 3-[[2-(4-bromo-2-methyl-phenyl)sulfanylacetyl]amino]-N-cyclopropyl-benzamide CAS Name: 3-[[2-[(4-bromo-2-methylphenyl)thio]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 3-[[2-(4-bromo-2-methylphenyl)sulfanylacetyl]amino]-N-cyclopropylbenzamide Traditional Name: 3-[[2-[(4-bromo-2-methyl-phenyl)thio]acetyl]amino]-N-cyclopropyl-benzamide Formula: C19H19BrN2O2S MolecularWeight: 419.33536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

InChI

InChI=1S/C19H19BrN2O2S/c1-12-9-14(20)5-8-17(12)25-11-18(23)21-16-4-2-3-13(10-16)19(24)22-15-6-7-15/h2-5,8-10,15H,6-7,11H2,1H3,(H,21,23)(H,22,24)