2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pentanamide

Systemtic Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pentanamide Openeye Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-morpholino-1,3-benzothiazol-6-yl)pentanamide CAS Name: 2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]pentanamide IUPAC Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)pentanamide Traditional Name: 2-[(4-fluorobenzyl)carbamoylamino]-N-(2-morpholino-1,3-benzothiazol-6-yl)valeramide Formula: C24H28FN5O3S MolecularWeight: 485.574223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CC2=C(C=C1)N=C(S2)N3CCOCC3)NC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CCCC(C(=O)NC1=CC2=C(C=C1)N=C(S2)N3CCOCC3)NC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C24H28FN5O3S/c1-2-3-20(28-23(32)26-15-16-4-6-17(25)7-5-16)22(31)27-18-8-9-19-21(14-18)34-24(29-19)30-10-12-33-13-11-30/h4-9,14,20H,2-3,10-13,15H2,1H3,(H,27,31)(H2,26,28,32)