N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide

Systemtic Name: N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Openeye Name: N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]-4-methylsulfanyl-2-[[(E)-styryl]sulfonylamino]butanamide CAS Name: N-[4-methyl-5-(1-methyl-2-imidazolyl)-2-thiazolyl]-4-(methylthio)-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide IUPAC Name: N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Traditional Name: N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]-4-(methylthio)-2-[[(E)-styryl]sulfonylamino]butyramide Formula: C21H25N5O3S3 MolecularWeight: 491.6499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C(CCSC)NS(=O)(=O)C=CC2=CC=CC=C2)C3=NC=CN3C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C(CCSC)NS(=O)(=O)/C=C/C2=CC=CC=C2)C3=NC=CN3C

InChI

InChI=1S/C21H25N5O3S3/c1-15-18(19-22-11-12-26(19)2)31-21(23-15)24-20(27)17(9-13-30-3)25-32(28,29)14-10-16-7-5-4-6-8-16/h4-8,10-12,14,17,25H,9,13H2,1-3H3,(H,23,24,27)/b14-10+