N-(3,3-dimethyl-2-oxidanylidene-butyl)-2-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]sulfanyl-benzamide

Systemtic Name: N-(3,3-dimethyl-2-oxidanylidene-butyl)-2-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]sulfanyl-benzamide Openeye Name: 2-[(1S)-2-anilino-1-methyl-2-oxo-ethyl]sulfanyl-N-(3,3-dimethyl-2-oxo-butyl)benzamide CAS Name: 2-[[(2S)-1-anilino-1-oxopropan-2-yl]thio]-N-(3,3-dimethyl-2-oxobutyl)benzamide IUPAC Name: 2-[(2S)-1-anilino-1-oxopropan-2-yl]sulfanyl-N-(3,3-dimethyl-2-oxobutyl)benzamide Traditional Name: 2-[[(1S)-2-anilino-2-keto-1-methyl-ethyl]thio]-N-(2-keto-3,3-dimethyl-butyl)benzamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=CC=CC=C2C(=O)NCC(=O)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1)SC2=CC=CC=C2C(=O)NCC(=O)C(C)(C)C

InChI

InChI=1S/C22H26N2O3S/c1-15(20(26)24-16-10-6-5-7-11-16)28-18-13-9-8-12-17(18)21(27)23-14-19(25)22(2,3)4/h5-13,15H,14H2,1-4H3,(H,23,27)(H,24,26)/t15-/m0/s1