3-cyclopentyl-N-cyclopropyl-N-[2-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]propanamide

Systemtic Name: 3-cyclopentyl-N-cyclopropyl-N-[2-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]propanamide Openeye Name: N-[2-[allyl-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]amino]-2-oxo-ethyl]-3-cyclopentyl-N-cyclopropyl-propanamide CAS Name: 3-cyclopentyl-N-cyclopropyl-N-[2-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl-prop-2-enylamino]-2-oxoethyl]propanamide IUPAC Name: 3-cyclopentyl-N-cyclopropyl-N-[2-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-prop-2-enylamino]-2-oxoethyl]propanamide Traditional Name: N-[2-[allyl-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]amino]-2-keto-ethyl]-3-cyclopentyl-N-cyclopropyl-propionamide Formula: C29H39N3O2 MolecularWeight: 461.63886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CN(CC=C)C(=O)CN(C3CC3)C(=O)CCC4CCCC4

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CN(CC=C)C(=O)CN(C3CC3)C(=O)CCC4CCCC4

InChI

InChI=1S/C29H39N3O2/c1-3-18-31(21-27-13-8-19-30(27)20-25-12-7-4-9-23(25)2)29(34)22-32(26-15-16-26)28(33)17-14-24-10-5-6-11-24/h3-4,7-9,12-13,19,24,26H,1,5-6,10-11,14-18,20-22H2,2H3