(6E)-5-azanylidene-6-[[1-[2-(4-methylphenoxy)ethyl]indol-3-yl]methylidene]-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: (6E)-5-azanylidene-6-[[1-[2-(4-methylphenoxy)ethyl]indol-3-yl]methylidene]-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: (6E)-2-(1-ethylpropyl)-5-imino-6-[[1-[2-(4-methylphenoxy)ethyl]indol-3-yl]methylene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: (6E)-5-imino-6-[[1-[2-(4-methylphenoxy)ethyl]-3-indolyl]methylidene]-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: (6E)-5-imino-6-[[1-[2-(4-methylphenoxy)ethyl]indol-3-yl]methylidene]-2-pentan-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: (6E)-2-(1-ethylpropyl)-5-imino-6-[[1-[2-(4-methylphenoxy)ethyl]indol-3-yl]methylene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C28H29N5O2S MolecularWeight: 499.62716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN2C(=N)C(=CC3=CN(C4=CC=CC=C43)CCOC5=CC=C(C=C5)C)C(=O)N=C2S1

Isomeric SMILES

CCC(CC)C1=NN2C(=N)/C(=C\C3=CN(C4=CC=CC=C43)CCOC5=CC=C(C=C5)C)/C(=O)N=C2S1

InChI

InChI=1S/C28H29N5O2S/c1-4-19(5-2)27-31-33-25(29)23(26(34)30-28(33)36-27)16-20-17-32(24-9-7-6-8-22(20)24)14-15-35-21-12-10-18(3)11-13-21/h6-13,16-17,19,29H,4-5,14-15H2,1-3H3/b23-16+,29-25?