N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-nitro-N-[(4-propan-2-ylphenyl)methyl]benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-nitro-N-[(4-propan-2-ylphenyl)methyl]benzamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(4-isopropylphenyl)methyl]-4-nitro-benzamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-4-nitro-N-[(4-propan-2-ylphenyl)methyl]benzamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-4-nitro-N-[(4-propan-2-ylphenyl)methyl]benzamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-N-(4-isopropylbenzyl)-4-nitro-benzamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN([C@H]2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O5S/c1-15(2)17-5-3-16(4-6-17)13-22(20-11-12-29(27,28)14-20)21(24)18-7-9-19(10-8-18)23(25)26/h3-10,15,20H,11-14H2,1-2H3/t20-/m0/s1