2-azanyl-3-[7-methoxy-1-(phenylsulfonyl)indol-4-yl]-N-(4-phenylbutyl)propanamide

Systemtic Name: 2-azanyl-3-[7-methoxy-1-(phenylsulfonyl)indol-4-yl]-N-(4-phenylbutyl)propanamide Openeye Name: 2-amino-3-[1-(benzenesulfonyl)-7-methoxy-indol-4-yl]-N-(4-phenylbutyl)propanamide CAS Name: 2-amino-3-[1-(benzenesulfonyl)-7-methoxy-4-indolyl]-N-(4-phenylbutyl)propanamide IUPAC Name: 2-amino-3-[1-(benzenesulfonyl)-7-methoxyindol-4-yl]-N-(4-phenylbutyl)propanamide Traditional Name: 2-amino-3-(1-besyl-7-methoxy-indol-4-yl)-N-(4-phenylbutyl)propionamide Formula: C28H31N3O4S MolecularWeight: 505.62844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)CC(C(=O)NCCCCC3=CC=CC=C3)N)C=CN2S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=C1)CC(C(=O)NCCCCC3=CC=CC=C3)N)C=CN2S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H31N3O4S/c1-35-26-16-15-22(20-25(29)28(32)30-18-9-8-12-21-10-4-2-5-11-21)24-17-19-31(27(24)26)36(33,34)23-13-6-3-7-14-23/h2-7,10-11,13-17,19,25H,8-9,12,18,20,29H2,1H3,(H,30,32)