piperidin-4-ylmethyl N-[3-[4-chloranyl-2-[(5-methylpyrazin-2-yl)carbamoylamino]phenoxy]propyl]carbamate

Systemtic Name: piperidin-4-ylmethyl N-[3-[4-chloranyl-2-[(5-methylpyrazin-2-yl)carbamoylamino]phenoxy]propyl]carbamate Openeye Name: 4-piperidylmethyl N-[3-[4-chloro-2-[(5-methylpyrazin-2-yl)carbamoylamino]phenoxy]propyl]carbamate CAS Name: N-[3-[4-chloro-2-[[[(5-methyl-2-pyrazinyl)amino]-oxomethyl]amino]phenoxy]propyl]carbamic acid 4-piperidinylmethyl ester IUPAC Name: piperidin-4-ylmethyl N-[3-[4-chloro-2-[(5-methylpyrazin-2-yl)carbamoylamino]phenoxy]propyl]carbamate Traditional Name: N-[3-[4-chloro-2-[(5-methylpyrazin-2-yl)carbamoylamino]phenoxy]propyl]carbamic acid 4-piperidylmethyl ester Formula: C22H29ClN6O4 MolecularWeight: 476.95646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)NC(=O)NC2=C(C=CC(=C2)Cl)OCCCNC(=O)OCC3CCNCC3

Isomeric SMILES

CC1=CN=C(C=N1)NC(=O)NC2=C(C=CC(=C2)Cl)OCCCNC(=O)OCC3CCNCC3

InChI

InChI=1S/C22H29ClN6O4/c1-15-12-27-20(13-26-15)29-21(30)28-18-11-17(23)3-4-19(18)32-10-2-7-25-22(31)33-14-16-5-8-24-9-6-16/h3-4,11-13,16,24H,2,5-10,14H2,1H3,(H,25,31)(H2,27,28,29,30)