2-[(5-chloranyl-1-benzothiophen-2-yl)methylamino]-3-(1H-indol-3-yl)-N-[(1S)-1-phenylethyl]propanamide

Systemtic Name: 2-[(5-chloranyl-1-benzothiophen-2-yl)methylamino]-3-(1H-indol-3-yl)-N-[(1S)-1-phenylethyl]propanamide Openeye Name: 2-[(5-chlorobenzothiophen-2-yl)methylamino]-3-(1H-indol-3-yl)-N-[(1S)-1-phenylethyl]propanamide CAS Name: 2-[(5-chloro-1-benzothiophen-2-yl)methylamino]-3-(1H-indol-3-yl)-N-[(1S)-1-phenylethyl]propanamide IUPAC Name: 2-[(5-chloro-1-benzothiophen-2-yl)methylamino]-3-(1H-indol-3-yl)-N-[(1S)-1-phenylethyl]propanamide Traditional Name: 2-[(5-chlorobenzothiophen-2-yl)methylamino]-3-(1H-indol-3-yl)-N-[(1S)-1-phenylethyl]propionamide Formula: C28H26ClN3OS MolecularWeight: 488.04354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(CC2=CNC3=CC=CC=C32)NCC4=CC5=C(S4)C=CC(=C5)Cl

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C(CC2=CNC3=CC=CC=C32)NCC4=CC5=C(S4)C=CC(=C5)Cl

InChI

InChI=1S/C28H26ClN3OS/c1-18(19-7-3-2-4-8-19)32-28(33)26(15-21-16-30-25-10-6-5-9-24(21)25)31-17-23-14-20-13-22(29)11-12-27(20)34-23/h2-14,16,18,26,30-31H,15,17H2,1H3,(H,32,33)/t18-,26?/m0/s1