N-[1-[[(E)-but-2-enyl]amino]-2-(furan-2-yl)ethyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[1-[[(E)-but-2-enyl]amino]-2-(furan-2-yl)ethyl]isoquinoline-5-sulfonamide Openeye Name: N-[1-[[(E)-but-2-enyl]amino]-2-(2-furyl)ethyl]isoquinoline-5-sulfonamide CAS Name: N-[1-[[(E)-but-2-enyl]amino]-2-(2-furanyl)ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-[1-[[(E)-but-2-enyl]amino]-2-(furan-2-yl)ethyl]isoquinoline-5-sulfonamide Traditional Name: N-[1-[[(E)-but-2-enyl]amino]-2-(2-furyl)ethyl]isoquinoline-5-sulfonamide Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCNC(CC1=CC=CO1)NS(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

C/C=C/CNC(CC1=CC=CO1)NS(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C19H21N3O3S/c1-2-3-10-21-19(13-16-7-5-12-25-16)22-26(23,24)18-8-4-6-15-14-20-11-9-17(15)18/h2-9,11-12,14,19,21-22H,10,13H2,1H3/b3-2+