[4-azanyl-2-[(4-pyrrolidin-3-yloxyphenyl)amino]-1,3-thiazol-5-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone

Systemtic Name: [4-azanyl-2-[(4-pyrrolidin-3-yloxyphenyl)amino]-1,3-thiazol-5-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone Openeye Name: [4-amino-2-(4-pyrrolidin-3-yloxyanilino)thiazol-5-yl]-(3-fluoro-4-methoxy-phenyl)methanone CAS Name: [4-amino-2-[4-(3-pyrrolidinyloxy)anilino]-5-thiazolyl]-(3-fluoro-4-methoxyphenyl)methanone IUPAC Name: [4-amino-2-(4-pyrrolidin-3-yloxyanilino)-1,3-thiazol-5-yl]-(3-fluoro-4-methoxyphenyl)methanone Traditional Name: [4-amino-2-(4-pyrrolidin-3-yloxyanilino)thiazol-5-yl]-(3-fluoro-4-methoxy-phenyl)methanone Formula: C21H21FN4O3S MolecularWeight: 428.479843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2=C(N=C(S2)NC3=CC=C(C=C3)OC4CCNC4)N)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C2=C(N=C(S2)NC3=CC=C(C=C3)OC4CCNC4)N)F

InChI

InChI=1S/C21H21FN4O3S/c1-28-17-7-2-12(10-16(17)22)18(27)19-20(23)26-21(30-19)25-13-3-5-14(6-4-13)29-15-8-9-24-11-15/h2-7,10,15,24H,8-9,11,23H2,1H3,(H,25,26)