3-[2-[4-azanyl-2-[(3,4,5-trimethoxyphenyl)amino]-1,3-thiazol-5-yl]-1,3-thiazol-4-yl]-N-(phenylmethyl)benzamide

Systemtic Name: 3-[2-[4-azanyl-2-[(3,4,5-trimethoxyphenyl)amino]-1,3-thiazol-5-yl]-1,3-thiazol-4-yl]-N-(phenylmethyl)benzamide Openeye Name: 3-[2-[4-amino-2-(3,4,5-trimethoxyanilino)thiazol-5-yl]thiazol-4-yl]-N-benzyl-benzamide CAS Name: 3-[2-[4-amino-2-(3,4,5-trimethoxyanilino)-5-thiazolyl]-4-thiazolyl]-N-(phenylmethyl)benzamide IUPAC Name: 3-[2-[4-amino-2-(3,4,5-trimethoxyanilino)-1,3-thiazol-5-yl]-1,3-thiazol-4-yl]-N-benzylbenzamide Traditional Name: 3-[2-[4-amino-2-(3,4,5-trimethoxyanilino)thiazol-5-yl]thiazol-4-yl]-N-benzyl-benzamide Formula: C29H27N5O4S2 MolecularWeight: 573.68578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC(=C(S2)C3=NC(=CS3)C4=CC(=CC=C4)C(=O)NCC5=CC=CC=C5)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC(=C(S2)C3=NC(=CS3)C4=CC(=CC=C4)C(=O)NCC5=CC=CC=C5)N

InChI

InChI=1S/C29H27N5O4S2/c1-36-22-13-20(14-23(37-2)24(22)38-3)32-29-34-26(30)25(40-29)28-33-21(16-39-28)18-10-7-11-19(12-18)27(35)31-15-17-8-5-4-6-9-17/h4-14,16H,15,30H2,1-3H3,(H,31,35)(H,32,34)