1-tert-butyl-3-(2,3-dithiophen-2-ylquinoxalin-6-yl)thiourea

Systemtic Name: 1-tert-butyl-3-(2,3-dithiophen-2-ylquinoxalin-6-yl)thiourea Openeye Name: 1-[2,3-bis(2-thienyl)quinoxalin-6-yl]-3-tert-butyl-thiourea CAS Name: 1-tert-butyl-3-(2,3-dithiophen-2-yl-6-quinoxalinyl)thiourea IUPAC Name: 1-tert-butyl-3-(2,3-dithiophen-2-ylquinoxalin-6-yl)thiourea Traditional Name: 1-[2,3-bis(2-thienyl)quinoxalin-6-yl]-3-tert-butyl-thiourea Formula: C21H20N4S3 MolecularWeight: 424.6053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC1=CC2=C(C=C1)N=C(C(=N2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CC(C)(C)NC(=S)NC1=CC2=C(C=C1)N=C(C(=N2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C21H20N4S3/c1-21(2,3)25-20(26)22-13-8-9-14-15(12-13)24-19(17-7-5-11-28-17)18(23-14)16-6-4-10-27-16/h4-12H,1-3H3,(H2,22,25,26)