(5-chloranyl-1H-indol-2-yl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (5-chloranyl-1H-indol-2-yl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (5-chloro-1H-indol-2-yl)-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (5-chloro-1H-indol-2-yl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (5-chloro-1H-indol-2-yl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (5-chloro-1H-indol-2-yl)-[4-(2-thenyl)-1,4-diazepan-1-yl]methanone Formula: C19H20ClN3OS MolecularWeight: 373.8996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC3=C(N2)C=CC(=C3)Cl)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC3=C(N2)C=CC(=C3)Cl)CC4=CC=CS4

InChI

InChI=1S/C19H20ClN3OS/c20-15-4-5-17-14(11-15)12-18(21-17)19(24)23-7-2-6-22(8-9-23)13-16-3-1-10-25-16/h1,3-5,10-12,21H,2,6-9,13H2