N-[(1S)-1-cyclopropylethyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-[(1S)-1-cyclopropylethyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-[(1S)-1-cyclopropylethyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-[(1S)-1-cyclopropylethyl]-4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-[(1S)-1-cyclopropylethyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-[(1S)-1-cyclopropylethyl]-4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CN3C

Isomeric SMILES

C[C@@H](C1CC1)NC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CN3C

InChI

InChI=1S/C18H22N4O2S/c1-12(13-3-4-13)20-17(24)14-5-7-15(8-6-14)21-16(23)11-25-18-19-9-10-22(18)2/h5-10,12-13H,3-4,11H2,1-2H3,(H,20,24)(H,21,23)/t12-/m0/s1