3-methyl-1-[(2-phenyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)amino]pyrrole-2,5-dione hydrochloride

Systemtic Name: 3-methyl-1-[(2-phenyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)amino]pyrrole-2,5-dione hydrochloride Openeye Name: 3-methyl-1-[[2-phenyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]pyrrole-2,5-dione hydrochloride CAS Name: 3-methyl-1-[(2-phenyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)amino]pyrrole-2,5-dione hydrochloride IUPAC Name: 3-methyl-1-[(2-phenyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]pyrrole-2,5-dione hydrochloride Traditional Name: 3-methyl-1-[[2-phenyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]-3-pyrroline-2,5-quinone hydrochloride Formula: C21H15ClN4O2S2 MolecularWeight: 454.9524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1=O)NC2=C3C(=CSC3=NC(=N2)C4=CC=CC=C4)C5=CC=CS5.Cl

Isomeric SMILES

CC1=CC(=O)N(C1=O)NC2=C3C(=CSC3=NC(=N2)C4=CC=CC=C4)C5=CC=CS5.Cl

InChI

InChI=1S/C21H14N4O2S2.ClH/c1-12-10-16(26)25(21(12)27)24-19-17-14(15-8-5-9-28-15)11-29-20(17)23-18(22-19)13-6-3-2-4-7-13;/h2-11H,1H3,(H,22,23,24);1H