N-[5-[(phenylmethyl)amino]pentan-2-yl]-N-propyl-isoquinoline-5-sulfonamide

Systemtic Name: N-[5-[(phenylmethyl)amino]pentan-2-yl]-N-propyl-isoquinoline-5-sulfonamide Openeye Name: N-[4-(benzylamino)-1-methyl-butyl]-N-propyl-isoquinoline-5-sulfonamide CAS Name: N-[5-[(phenylmethyl)amino]pentan-2-yl]-N-propyl-5-isoquinolinesulfonamide IUPAC Name: N-[5-(benzylamino)pentan-2-yl]-N-propylisoquinoline-5-sulfonamide Traditional Name: N-[4-(benzylamino)-1-methyl-butyl]-N-propyl-isoquinoline-5-sulfonamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(C)CCCNCC1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCN(C(C)CCCNCC1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C24H31N3O2S/c1-3-17-27(20(2)9-8-15-25-18-21-10-5-4-6-11-21)30(28,29)24-13-7-12-22-19-26-16-14-23(22)24/h4-7,10-14,16,19-20,25H,3,8-9,15,17-18H2,1-2H3