carbamoyl chloride; 1-[4-[[5-(3-ethoxy-4-methoxy-phenyl)-6-ethyl-2-oxidanylidene-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]urea

Systemtic Name: carbamoyl chloride; 1-[4-[[5-(3-ethoxy-4-methoxy-phenyl)-6-ethyl-2-oxidanylidene-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]urea Openeye Name: carbamoyl chloride; [4-[[5-(3-ethoxy-4-methoxy-phenyl)-6-ethyl-2-oxo-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]urea CAS Name: carbamoyl chloride; [4-[[5-(3-ethoxy-4-methoxyphenyl)-6-ethyl-2-oxo-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]urea IUPAC Name: carbamoyl chloride; [4-[[5-(3-ethoxy-4-methoxyphenyl)-6-ethyl-2-oxo-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]urea Traditional Name: carbamoyl chloride; [4-[[5-(3-ethoxy-4-methoxy-phenyl)-6-ethyl-2-keto-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]urea Formula: C23H28ClN5O5S MolecularWeight: 522.01692

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=NN(C(=O)S1)CC2=CC=C(C=C2)NC(=O)N)C3=CC(=C(C=C3)OC)OCC.C(=O)(N)Cl

Isomeric SMILES

CCC1C(=NN(C(=O)S1)CC2=CC=C(C=C2)NC(=O)N)C3=CC(=C(C=C3)OC)OCC.C(=O)(N)Cl

InChI

InChI=1S/C22H26N4O4S.CH2ClNO/c1-4-19-20(15-8-11-17(29-3)18(12-15)30-5-2)25-26(22(28)31-19)13-14-6-9-16(10-7-14)24-21(23)27;2-1(3)4/h6-12,19H,4-5,13H2,1-3H3,(H3,23,24,27);(H2,3,4)