9-thiophen-2-yl-6-thiophen-3-yl-5,6,6a,8,9,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 9-thiophen-2-yl-6-thiophen-3-yl-5,6,6a,8,9,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one Openeye Name: 9-(2-thienyl)-6-(3-thienyl)-5,6,6a,8,9,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one CAS Name: 9-thiophen-2-yl-6-(3-thiophenyl)-5,6,6a,8,9,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one IUPAC Name: 9-thiophen-2-yl-6-thiophen-3-yl-5,6,6a,8,9,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one Traditional Name: 9-(2-thienyl)-6-(3-thienyl)-5,6,6a,8,9,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one Formula: C21H18N2OS2 MolecularWeight: 378.51042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C=C2C(C1=O)C(NC3=CC=CC=C3N2)C4=CSC=C4)C5=CC=CS5

Isomeric SMILES

C1C(C=C2C(C1=O)C(NC3=CC=CC=C3N2)C4=CSC=C4)C5=CC=CS5

InChI

InChI=1S/C21H18N2OS2/c24-18-11-14(19-6-3-8-26-19)10-17-20(18)21(13-7-9-25-12-13)23-16-5-2-1-4-15(16)22-17/h1-10,12,14,20-23H,11H2