N-cyclopropyl-4-fluoranyl-N-[2-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: N-cyclopropyl-4-fluoranyl-N-[2-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[2-[allyl-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]amino]-2-oxo-ethyl]-N-cyclopropyl-4-fluoro-benzamide CAS Name: N-cyclopropyl-4-fluoro-N-[2-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl-prop-2-enylamino]-2-oxoethyl]benzamide IUPAC Name: N-cyclopropyl-4-fluoro-N-[2-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-prop-2-enylamino]-2-oxoethyl]benzamide Traditional Name: N-[2-[allyl-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]amino]-2-keto-ethyl]-N-cyclopropyl-4-fluoro-benzamide Formula: C28H30FN3O2 MolecularWeight: 459.555103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CN(CC=C)C(=O)CN(C3CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CN(CC=C)C(=O)CN(C3CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C28H30FN3O2/c1-3-16-31(19-26-9-6-17-30(26)18-23-8-5-4-7-21(23)2)27(33)20-32(25-14-15-25)28(34)22-10-12-24(29)13-11-22/h3-13,17,25H,1,14-16,18-20H2,2H3