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

Systemtic Name: 4-azanyl-N-[cycloheptyl-(1-methylpyrrolidin-2-yl)methyl]-5-ethylsulfonyl-2-methoxy-benzamide Openeye Name: 4-amino-N-[cycloheptyl-(1-methylpyrrolidin-2-yl)methyl]-5-ethylsulfonyl-2-methoxy-benzamide CAS Name: 4-amino-N-[cycloheptyl-(1-methyl-2-pyrrolidinyl)methyl]-5-ethylsulfonyl-2-methoxybenzamide IUPAC Name: 4-amino-N-[cycloheptyl-(1-methylpyrrolidin-2-yl)methyl]-5-ethylsulfonyl-2-methoxybenzamide Traditional Name: 4-amino-N-[cycloheptyl-(1-methylpyrrolidin-2-yl)methyl]-5-esyl-2-methoxy-benzamide Formula: C23H37N3O4S MolecularWeight: 451.62258

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)NC(C2CCCCCC2)C3CCCN3C)OC)N

Isomeric SMILES

CCS(=O)(=O)C1=C(C=C(C(=C1)C(=O)NC(C2CCCCCC2)C3CCCN3C)OC)N

InChI

InChI=1S/C23H37N3O4S/c1-4-31(28,29)21-14-17(20(30-3)15-18(21)24)23(27)25-22(19-12-9-13-26(19)2)16-10-7-5-6-8-11-16/h14-16,19,22H,4-13,24H2,1-3H3,(H,25,27)