[2-[4-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-6-methyl-1-benzothiophen-3-yl]-[3-methoxy-4-(morpholin-4-ylmethyl)phenyl]methanone

Systemtic Name: [2-[4-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-6-methyl-1-benzothiophen-3-yl]-[3-methoxy-4-(morpholin-4-ylmethyl)phenyl]methanone Openeye Name: [2-[4-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-6-methyl-benzothiophen-3-yl]-[3-methoxy-4-(morpholinomethyl)phenyl]methanone CAS Name: [2-[4-[2-[2-(hydroxymethyl)-1-pyrrolidinyl]ethoxy]phenyl]-6-methyl-1-benzothiophen-3-yl]-[3-methoxy-4-(4-morpholinylmethyl)phenyl]methanone IUPAC Name: [2-[4-[2-[2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-6-methyl-1-benzothiophen-3-yl]-[3-methoxy-4-(morpholin-4-ylmethyl)phenyl]methanone Traditional Name: [3-methoxy-4-(morpholinomethyl)phenyl]-[6-methyl-2-[4-[2-(2-methylolpyrrolidino)ethoxy]phenyl]benzothiophen-3-yl]methanone Formula: C35H40N2O5S MolecularWeight: 600.7675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)OCCN4CCCC4CO)C(=O)C5=CC(=C(C=C5)CN6CCOCC6)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)OCCN4CCCC4CO)C(=O)C5=CC(=C(C=C5)CN6CCOCC6)OC

InChI

InChI=1S/C35H40N2O5S/c1-24-5-12-30-32(20-24)43-35(25-8-10-29(11-9-25)42-19-16-37-13-3-4-28(37)23-38)33(30)34(39)26-6-7-27(31(21-26)40-2)22-36-14-17-41-18-15-36/h5-12,20-21,28,38H,3-4,13-19,22-23H2,1-2H3