4-azanyl-5-ethylsulfonyl-2-methoxy-N-[[1-(phenylmethyl)pyrrolidin-2-yl]methyl]benzamide

Systemtic Name: 4-azanyl-5-ethylsulfonyl-2-methoxy-N-[[1-(phenylmethyl)pyrrolidin-2-yl]methyl]benzamide Openeye Name: 4-amino-N-[(1-benzylpyrrolidin-2-yl)methyl]-5-ethylsulfonyl-2-methoxy-benzamide CAS Name: 4-amino-5-ethylsulfonyl-2-methoxy-N-[[1-(phenylmethyl)-2-pyrrolidinyl]methyl]benzamide IUPAC Name: 4-amino-N-[(1-benzylpyrrolidin-2-yl)methyl]-5-ethylsulfonyl-2-methoxybenzamide Traditional Name: 4-amino-N-[(1-benzylpyrrolidin-2-yl)methyl]-5-esyl-2-methoxy-benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)NCC2CCCN2CC3=CC=CC=C3)OC)N

Isomeric SMILES

CCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)NCC2CCCN2CC3=CC=CC=C3)OC)N

InChI

InChI=1S/C22H29N3O4S/c1-3-30(27,28)21-12-18(20(29-2)13-19(21)23)22(26)24-14-17-10-7-11-25(17)15-16-8-5-4-6-9-16/h4-6,8-9,12-13,17H,3,7,10-11,14-15,23H2,1-2H3,(H,24,26)