N-[4-[(E)-3-(1H-indol-3-yl)-2-isocyano-prop-2-enoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[(E)-3-(1H-indol-3-yl)-2-isocyano-prop-2-enoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[(E)-3-(1H-indol-3-yl)-2-isocyano-prop-2-enoyl]phenyl]methanesulfonamide CAS Name: N-[4-[(E)-3-(1H-indol-3-yl)-2-isocyano-1-oxoprop-2-enyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[(E)-3-(1H-indol-3-yl)-2-isocyanoprop-2-enoyl]phenyl]methanesulfonamide Traditional Name: N-[4-[(E)-3-(1H-indol-3-yl)-2-isocyano-acryloyl]phenyl]methanesulfonamide Formula: C19H15N3O3S MolecularWeight: 365.4057

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C(=CC2=CNC3=CC=CC=C32)[N+]#[C-]

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)/C(=C\C2=CNC3=CC=CC=C32)/[N+]#[C-]

InChI

InChI=1S/C19H15N3O3S/c1-20-18(11-14-12-21-17-6-4-3-5-16(14)17)19(23)13-7-9-15(10-8-13)22-26(2,24)25/h3-12,21-22H,2H3/b18-11+