N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-[(4-bromophenyl)sulfonylamino]propanamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-[(4-bromophenyl)sulfonylamino]propanamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-3-[(4-bromophenyl)sulfonylamino]propanamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-3-[(4-bromophenyl)sulfonylamino]propanamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-[(4-bromophenyl)sulfonylamino]propanamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-3-(brosylamino)propionamide Formula: C15H17BrN4O4S3 MolecularWeight: 493.41888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Br)SCC(=O)N

InChI

InChI=1S/C15H17BrN4O4S3/c1-9-14(25-8-12(17)21)26-15(19-9)20-13(22)6-7-18-27(23,24)11-4-2-10(16)3-5-11/h2-5,18H,6-8H2,1H3,(H2,17,21)(H,19,20,22)