2-[4-[2-[2-cyanoethyl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-cyclopropyl-propanamide

Systemtic Name: 2-[4-[2-[2-cyanoethyl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-cyclopropyl-propanamide Openeye Name: 2-[4-[2-[2-cyanoethyl(2-furylmethyl)amino]-2-oxo-ethyl]piperazin-1-yl]-N-cyclopropyl-propanamide CAS Name: 2-[4-[2-[2-cyanoethyl(2-furanylmethyl)amino]-2-oxoethyl]-1-piperazinyl]-N-cyclopropylpropanamide IUPAC Name: 2-[4-[2-[2-cyanoethyl(furan-2-ylmethyl)amino]-2-oxoethyl]piperazin-1-yl]-N-cyclopropylpropanamide Traditional Name: 2-[4-[2-[2-cyanoethyl(2-furfuryl)amino]-2-keto-ethyl]piperazino]-N-cyclopropyl-propionamide Formula: C20H29N5O3 MolecularWeight: 387.47596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)N2CCN(CC2)CC(=O)N(CCC#N)CC3=CC=CO3

Isomeric SMILES

CC(C(=O)NC1CC1)N2CCN(CC2)CC(=O)N(CCC#N)CC3=CC=CO3

InChI

InChI=1S/C20H29N5O3/c1-16(20(27)22-17-5-6-17)24-11-9-23(10-12-24)15-19(26)25(8-3-7-21)14-18-4-2-13-28-18/h2,4,13,16-17H,3,5-6,8-12,14-15H2,1H3,(H,22,27)