2-[methylsulfonyl-(4-phenoxyphenyl)amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide

Systemtic Name: 2-[methylsulfonyl-(4-phenoxyphenyl)amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide Openeye Name: 2-(N-methylsulfonyl-4-phenoxy-anilino)-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide CAS Name: 2-(N-methylsulfonyl-4-phenoxyanilino)-N-[[4-(1-pyrrolidinyl)phenyl]methyl]propanamide IUPAC Name: 2-(N-methylsulfonyl-4-phenoxyanilino)-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide Traditional Name: 2-(N-mesyl-4-phenoxy-anilino)-N-(4-pyrrolidinobenzyl)propionamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)N2CCCC2)N(C3=CC=C(C=C3)OC4=CC=CC=C4)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)N2CCCC2)N(C3=CC=C(C=C3)OC4=CC=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C27H31N3O4S/c1-21(27(31)28-20-22-10-12-23(13-11-22)29-18-6-7-19-29)30(35(2,32)33)24-14-16-26(17-15-24)34-25-8-4-3-5-9-25/h3-5,8-17,21H,6-7,18-20H2,1-2H3,(H,28,31)