3-chloranyl-N-[2-(3-indol-1-ylpropylamino)-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(3-indol-1-ylpropylamino)-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(3-indol-1-ylpropylamino)-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[3-(1-indolyl)propylamino]-2-oxoethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(3-indol-1-ylpropylamino)-2-oxoethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(3-indol-1-ylpropylamino)-2-keto-ethyl]benzothiophene-2-carboxamide Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2CCCNC(=O)CNC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2CCCNC(=O)CNC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C22H20ClN3O2S/c23-20-16-7-2-4-9-18(16)29-21(20)22(28)25-14-19(27)24-11-5-12-26-13-10-15-6-1-3-8-17(15)26/h1-4,6-10,13H,5,11-12,14H2,(H,24,27)(H,25,28)