4-chloranyl-N-[4-[2,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-3-yl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[4-[2,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-3-yl]-1,3-thiazol-2-yl]benzamide Openeye Name: 4-chloro-N-[4-[2,5-dimethyl-1-(tetrahydrofuran-2-ylmethyl)pyrrol-3-yl]thiazol-2-yl]benzamide CAS Name: 4-chloro-N-[4-[2,5-dimethyl-1-(2-oxolanylmethyl)-3-pyrrolyl]-2-thiazolyl]benzamide IUPAC Name: 4-chloro-N-[4-[2,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-3-yl]-1,3-thiazol-2-yl]benzamide Traditional Name: 4-chloro-N-[4-[2,5-dimethyl-1-(tetrahydrofurfuryl)pyrrol-3-yl]thiazol-2-yl]benzamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2CCCO2)C)C3=CSC(=N3)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=C(N1CC2CCCO2)C)C3=CSC(=N3)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-13-10-18(14(2)25(13)11-17-4-3-9-27-17)19-12-28-21(23-19)24-20(26)15-5-7-16(22)8-6-15/h5-8,10,12,17H,3-4,9,11H2,1-2H3,(H,23,24,26)