1-[2-[(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]ethanoylamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[2-[(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]ethanoylamino]-3-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-[[2-[[4-oxo-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methylsulfanyl]acetyl]amino]thiourea CAS Name: 1-[[1-oxo-2-[(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]ethyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[[2-[(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]acetyl]amino]-3-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-[[2-[[4-keto-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methylthio]acetyl]amino]thiourea Formula: C17H19N5O2S4 MolecularWeight: 453.62506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)CSCC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1

Isomeric SMILES

CC(C)NC(=S)NNC(=O)CSCC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1

InChI

InChI=1S/C17H19N5O2S4/c1-9(2)18-17(25)22-21-13(23)8-26-7-12-19-15(24)14-10(6-28-16(14)20-12)11-4-3-5-27-11/h3-6,9H,7-8H2,1-2H3,(H,21,23)(H2,18,22,25)(H,19,20,24)