2-[2-[(2-ethylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-N-propyl-benzamide

Systemtic Name: 2-[2-[(2-ethylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-N-propyl-benzamide Openeye Name: 2-[[2-[2-ethyl-N-(p-tolylsulfonyl)anilino]acetyl]amino]-N-propyl-benzamide CAS Name: 2-[[2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]-N-propylbenzamide IUPAC Name: 2-[[2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]-N-propylbenzamide Traditional Name: 2-[[2-(2-ethyl-N-tosyl-anilino)acetyl]amino]-N-propyl-benzamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC=CC=C2CC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC=CC=C2CC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C27H31N3O4S/c1-4-18-28-27(32)23-11-7-8-12-24(23)29-26(31)19-30(25-13-9-6-10-21(25)5-2)35(33,34)22-16-14-20(3)15-17-22/h6-17H,4-5,18-19H2,1-3H3,(H,28,32)(H,29,31)