N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-[(phenylmethyl)sulfonyl-propyl-amino]ethanamide

Systemtic Name: N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]-2-[(phenylmethyl)sulfonyl-propyl-amino]ethanamide Openeye Name: 2-[benzylsulfonyl(propyl)amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: N-cyclopropyl-N-[(1-methyl-2-pyrrolyl)methyl]-2-[(phenylmethyl)sulfonyl-propylamino]acetamide IUPAC Name: 2-[benzylsulfonyl(propyl)amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[benzylsulfonyl(propyl)amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)N(CC1=CC=CN1C)C2CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCCN(CC(=O)N(CC1=CC=CN1C)C2CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H29N3O3S/c1-3-13-23(28(26,27)17-18-8-5-4-6-9-18)16-21(25)24(19-11-12-19)15-20-10-7-14-22(20)2/h4-10,14,19H,3,11-13,15-17H2,1-2H3