N-[1-[2,3-bis(phenylmethyl)-4-propan-2-ylsulfonyl-phenyl]-3-oxidanylidene-propyl]methanamide

Systemtic Name: N-[1-[2,3-bis(phenylmethyl)-4-propan-2-ylsulfonyl-phenyl]-3-oxidanylidene-propyl]methanamide Openeye Name: N-[1-(2,3-dibenzyl-4-isopropylsulfonyl-phenyl)-3-oxo-propyl]formamide CAS Name: N-[1-[2,3-bis(phenylmethyl)-4-propan-2-ylsulfonylphenyl]-3-oxopropyl]formamide IUPAC Name: N-[1-(2,3-dibenzyl-4-propan-2-ylsulfonylphenyl)-3-oxopropyl]formamide Traditional Name: N-[1-(2,3-dibenzyl-4-isopropylsulfonyl-phenyl)-3-keto-propyl]formamide Formula: C27H29NO4S MolecularWeight: 463.58846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C(=C(C=C1)C(CC=O)NC=O)CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C(=C(C=C1)C(CC=O)NC=O)CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C27H29NO4S/c1-20(2)33(31,32)27-14-13-23(26(15-16-29)28-19-30)24(17-21-9-5-3-6-10-21)25(27)18-22-11-7-4-8-12-22/h3-14,16,19-20,26H,15,17-18H2,1-2H3,(H,28,30)