N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]-4-[methyl(2-thienylsulfonyl)amino]butanamide CAS Name: N-[4-(2-amino-2-oxoethyl)-2-thiazolyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)thiazol-2-yl]-4-[methyl(2-thienylsulfonyl)amino]butyramide Formula: C14H18N4O4S3 MolecularWeight: 402.51212

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NC1=NC(=CS1)CC(=O)N)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CN(CCCC(=O)NC1=NC(=CS1)CC(=O)N)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C14H18N4O4S3/c1-18(25(21,22)13-5-3-7-23-13)6-2-4-12(20)17-14-16-10(9-24-14)8-11(15)19/h3,5,7,9H,2,4,6,8H2,1H3,(H2,15,19)(H,16,17,20)