N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanamide

Systemtic Name: N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanamide Openeye Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-[2-(cyclopropylamino)-2-oxo-ethyl]butanamide CAS Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-[2-(cyclopropylamino)-2-oxoethyl]butanamide IUPAC Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-[2-(cyclopropylamino)-2-oxoethyl]butanamide Traditional Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-[2-(cyclopropylamino)-2-keto-ethyl]butyramide Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NCC(=O)NC2CC2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NCC(=O)NC2CC2

InChI

InChI=1S/C18H25N3O5S/c1-13(22)14-5-9-16(10-6-14)27(25,26)21(2)11-3-4-17(23)19-12-18(24)20-15-7-8-15/h5-6,9-10,15H,3-4,7-8,11-12H2,1-2H3,(H,19,23)(H,20,24)