4-[[[2-(butylamino)-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)amino]methyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[[2-(butylamino)-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)amino]methyl]-N-cyclopropyl-benzamide Openeye Name: 4-[[[2-(butylamino)-2-oxo-ethyl]-(2-furylmethyl)amino]methyl]-N-cyclopropyl-benzamide CAS Name: 4-[[[2-(butylamino)-2-oxoethyl]-(2-furanylmethyl)amino]methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[[[2-(butylamino)-2-oxoethyl]-(furan-2-ylmethyl)amino]methyl]-N-cyclopropylbenzamide Traditional Name: 4-[[[2-(butylamino)-2-keto-ethyl]-(2-furfuryl)amino]methyl]-N-cyclopropyl-benzamide Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN(CC1=CC=C(C=C1)C(=O)NC2CC2)CC3=CC=CO3

Isomeric SMILES

CCCCNC(=O)CN(CC1=CC=C(C=C1)C(=O)NC2CC2)CC3=CC=CO3

InChI

InChI=1S/C22H29N3O3/c1-2-3-12-23-21(26)16-25(15-20-5-4-13-28-20)14-17-6-8-18(9-7-17)22(27)24-19-10-11-19/h4-9,13,19H,2-3,10-12,14-16H2,1H3,(H,23,26)(H,24,27)