N-[1-[[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[1-[[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[1-[[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[1-[[4-methyl-5-(1-methyl-2-imidazolyl)-2-thiazolyl]amino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[1-[[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[1-[[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C20H23N5O2S2 MolecularWeight: 429.55892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O2S2/c1-13-16(17-21-10-11-25(17)2)29-20(22-13)24-19(27)15(9-12-28-3)23-18(26)14-7-5-4-6-8-14/h4-8,10-11,15H,9,12H2,1-3H3,(H,23,26)(H,22,24,27)