1-(2-azanylethyl)-7-[(3-chloranyl-1-benzothiophen-2-yl)methyl]pyrrolo[2,3-f]isoquinolin-6-one

Systemtic Name: 1-(2-azanylethyl)-7-[(3-chloranyl-1-benzothiophen-2-yl)methyl]pyrrolo[2,3-f]isoquinolin-6-one Openeye Name: 1-(2-aminoethyl)-7-[(3-chlorobenzothiophen-2-yl)methyl]pyrrolo[2,3-f]isoquinolin-6-one CAS Name: 1-(2-aminoethyl)-7-[(3-chloro-1-benzothiophen-2-yl)methyl]-6-pyrrolo[2,3-f]isoquinolinone IUPAC Name: 1-(2-aminoethyl)-7-[(3-chloro-1-benzothiophen-2-yl)methyl]pyrrolo[2,3-f]isoquinolin-6-one Traditional Name: 1-(2-aminoethyl)-7-[(3-chlorobenzothiophen-2-yl)methyl]pyrrol[2,3-f]isoquinolin-6-one Formula: C22H18ClN3OS MolecularWeight: 407.91582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)CN3C=CC4=C(C3=O)C=CC5=C4N(C=C5)CCN)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)CN3C=CC4=C(C3=O)C=CC5=C4N(C=C5)CCN)Cl

InChI

InChI=1S/C22H18ClN3OS/c23-20-17-3-1-2-4-18(17)28-19(20)13-26-11-8-15-16(22(26)27)6-5-14-7-10-25(12-9-24)21(14)15/h1-8,10-11H,9,12-13,24H2