4-[[(E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[(E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]-N-cyclopropyl-benzamide Openeye Name: 4-[[(E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]-N-cyclopropyl-benzamide CAS Name: 4-[[(E)-3-[1-(2-cyanoethyl)-3-indolyl]-1-oxoprop-2-enyl]amino]-N-cyclopropylbenzamide IUPAC Name: 4-[[(E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]amino]-N-cyclopropylbenzamide Traditional Name: 4-[[(E)-3-[1-(2-cyanoethyl)indol-3-yl]acryloyl]amino]-N-cyclopropyl-benzamide Formula: C24H22N4O2 MolecularWeight: 398.45708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)NC(=O)C=CC3=CN(C4=CC=CC=C43)CCC#N

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)NC(=O)/C=C/C3=CN(C4=CC=CC=C43)CCC#N

InChI

InChI=1S/C24H22N4O2/c25-14-3-15-28-16-18(21-4-1-2-5-22(21)28)8-13-23(29)26-19-9-6-17(7-10-19)24(30)27-20-11-12-20/h1-2,4-10,13,16,20H,3,11-12,15H2,(H,26,29)(H,27,30)/b13-8+