N-cyclopropyl-2-[3-methoxypropyl-(phenylmethyl)sulfonyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]ethanamide

Systemtic Name: N-cyclopropyl-2-[3-methoxypropyl-(phenylmethyl)sulfonyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]ethanamide Openeye Name: 2-[benzylsulfonyl(3-methoxypropyl)amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: N-cyclopropyl-2-[3-methoxypropyl-(phenylmethyl)sulfonylamino]-N-[(1-methyl-2-pyrrolyl)methyl]acetamide IUPAC Name: 2-[benzylsulfonyl(3-methoxypropyl)amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[benzylsulfonyl(3-methoxypropyl)amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(C2CC2)C(=O)CN(CCCOC)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CN1C=CC=C1CN(C2CC2)C(=O)CN(CCCOC)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H31N3O4S/c1-23-13-6-10-21(23)16-25(20-11-12-20)22(26)17-24(14-7-15-29-2)30(27,28)18-19-8-4-3-5-9-19/h3-6,8-10,13,20H,7,11-12,14-18H2,1-2H3