N-[5-[2-(methoxymethyl)-4-(pentan-3-ylcarbamoylamino)phenoxy]-1,3-thiazol-2-yl]-4-[3-[(4-oxidanylpiperidin-1-yl)methyl]indol-1-yl]benzamide

Systemtic Name: N-[5-[2-(methoxymethyl)-4-(pentan-3-ylcarbamoylamino)phenoxy]-1,3-thiazol-2-yl]-4-[3-[(4-oxidanylpiperidin-1-yl)methyl]indol-1-yl]benzamide Openeye Name: N-[5-[4-(1-ethylpropylcarbamoylamino)-2-(methoxymethyl)phenoxy]thiazol-2-yl]-4-[3-[(4-hydroxy-1-piperidyl)methyl]indol-1-yl]benzamide CAS Name: 4-[3-[(4-hydroxy-1-piperidinyl)methyl]-1-indolyl]-N-[5-[2-(methoxymethyl)-4-[[oxo-(pentan-3-ylamino)methyl]amino]phenoxy]-2-thiazolyl]benzamide IUPAC Name: 4-[3-[(4-hydroxypiperidin-1-yl)methyl]indol-1-yl]-N-[5-[2-(methoxymethyl)-4-(pentan-3-ylcarbamoylamino)phenoxy]-1,3-thiazol-2-yl]benzamide Traditional Name: N-[5-[4-(1-ethylpropylcarbamoylamino)-2-(methoxymethyl)phenoxy]thiazol-2-yl]-4-[3-[(4-hydroxypiperidino)methyl]indol-1-yl]benzamide Formula: C38H44N6O5S MolecularWeight: 696.85816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)NC1=CC(=C(C=C1)OC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)N4C=C(C5=CC=CC=C54)CN6CCC(CC6)O)COC

Isomeric SMILES

CCC(CC)NC(=O)NC1=CC(=C(C=C1)OC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)N4C=C(C5=CC=CC=C54)CN6CCC(CC6)O)COC

InChI

InChI=1S/C38H44N6O5S/c1-4-28(5-2)40-37(47)41-29-12-15-34(26(20-29)24-48-3)49-35-21-39-38(50-35)42-36(46)25-10-13-30(14-11-25)44-23-27(32-8-6-7-9-33(32)44)22-43-18-16-31(45)17-19-43/h6-15,20-21,23,28,31,45H,4-5,16-19,22,24H2,1-3H3,(H,39,42,46)(H2,40,41,47)