N-[2-azanyl-5-(1-benzothiophen-2-yl)phenyl]-4-[[(3,4-dimethoxyphenyl)amino]methyl]benzamide

Systemtic Name: N-[2-azanyl-5-(1-benzothiophen-2-yl)phenyl]-4-[[(3,4-dimethoxyphenyl)amino]methyl]benzamide Openeye Name: N-[2-amino-5-(benzothiophen-2-yl)phenyl]-4-[(3,4-dimethoxyanilino)methyl]benzamide CAS Name: N-[2-amino-5-(1-benzothiophen-2-yl)phenyl]-4-[(3,4-dimethoxyanilino)methyl]benzamide IUPAC Name: N-[2-amino-5-(1-benzothiophen-2-yl)phenyl]-4-[(3,4-dimethoxyanilino)methyl]benzamide Traditional Name: N-[2-amino-5-(benzothiophen-2-yl)phenyl]-4-[(3,4-dimethoxyanilino)methyl]benzamide Formula: C30H27N3O3S MolecularWeight: 509.61868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NCC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC5=CC=CC=C5S4)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NCC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC5=CC=CC=C5S4)N)OC

InChI

InChI=1S/C30H27N3O3S/c1-35-26-14-12-23(17-27(26)36-2)32-18-19-7-9-20(10-8-19)30(34)33-25-15-22(11-13-24(25)31)29-16-21-5-3-4-6-28(21)37-29/h3-17,32H,18,31H2,1-2H3,(H,33,34)